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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 13 results

Search term: VXUKDVBPBWVORY (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
17515481

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14-,15-,18-/m1/s1
C19H23N7O6445.4292141300
7926387

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+
C19H23N7O6445.42925200
17540235

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14-,15+,18-/m1/s1
C19H23N7O6445.42923200
62540142

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14+,15-,18+/m0/s1
C19H23N7O6445.42922200
62575156

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14-,15+,18+/m1/s1
C19H23N7O6445.42922200
62575157

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14+,15+,18-/m0/s1
C19H23N7O6445.42922200
62575158

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14+,15+,18+/m0/s1
C19H23N7O6445.42922200
62575159

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14+,15-,18-/m0/s1
C19H23N7O6445.42922200
3414012

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)
C19H23N7O6445.429222100
5364464

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/t12-,14-,15-,18-/m0/s1
C19H23N7O6445.42922100
5364465

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6-/t12-,14-,15-,18-/m0/s1
C19H23N7O6445.42922100
35360905

Double-bond stereo

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/t12-,14-,15-,18-/m1/s1
C19H23N7O6445.42921100
62391673

Double-bond stereo

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C19H23N7O6/c1-30-10-4-3-9(5-11(10)31-2)6-23-25-19-24-13-16(20)21-8-22-17(13)26(19)18-15(29)14(28)12(7-27)32-18/h3-6,8,12,14-15,18,27-29H,7H2,1-2H3,(H,24,25)(H2,20,21,22)/b23-6+/t12-,14-,15-,18-/m0/s1
C19H23N7O6445.42921100

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