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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 41 results

Search term: JYHCQVWYCGHXGP (Found by InChIKey (skeleton match))
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
4444449

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9-,10-,15-,21+,22-/m0/s1
C22H24N2O8444.43456131600
4576627

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9-,10-,15+,21+,22-/m0/s1
C22H24N2O8444.43465400
4593685

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9-,10-,15-,21?,22-/m0/s1
C22H24N2O8444.43464400
64915

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10-,15+,21+,22-/m0/s1
C22H24N2O8444.43463100
5185811

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10+,15+,21-,22+/m1/s1
C22H24N2O8444.43463200
4535016

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14+/t9-,10-,15-,21+,22-/m0/s1
C22H24N2O8444.43463100
4514242

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9?,10-,15-,21+,22-/m0/s1
C22H24N2O8444.43462200
5408956

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10-,15-,21+,22+/m0/s1
C22H24N2O8444.43462100
5436160

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10+,15-,21-,22+/m0/s1
C22H24N2O8444.43462100
5436162

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10+,15-,21-,22-/m0/s1
C22H24N2O8444.43462100
8043771

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14+/t9?,10-,15-,21+,22-/m0/s1
C22H24N2O8444.43462100
8067024

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9?,10?,15-,21-,22+/m0/s1
C22H24N2O8444.43462100
13076861

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-/t9?,10?,15-,21+,22-/m0/s1
C22H24N2O8444.43462200
72184

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10-,15-,21+,22-/m0/s1
C22H24N2O8444.43462100
137295

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10-,15-,21-,22-/m0/s1
C22H24N2O8444.43462100
1265948

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10+,15-,21+,22+/m1/s1
C22H24N2O8444.43462100
2496986

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/t9-,10-,15-,21-,22+/m0/s1
C22H24N2O8444.43462100
4932151

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14+/t9?,10?,15-,21+,22-/m0/s1
C22H24N2O8444.43462200
5185810

Charge

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/p+1/t9-,10+,15+,21-,22+/m1/s1
C22H25N2O8445.4422200
5436161

Charge

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/p+1/t9-,10+,15-,21-,22-/m0/s1
C22H25N2O8445.4421100
123

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