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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 15 results

Search term: TYOGSRFPSVCJQL (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
10186295

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+/t16-,17+,18+,19+,20-,22+,24-/m1/s1
C24H35NO5417.53849910
8312255

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+
C24H35NO5417.53846200
9398874

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+/t16-,17-,18-,19-,20+,22-,24+/m0/s1
C24H35NO5417.53843200
58131213

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8-,14-11-/t16-,17+,18+,19+,20-,22+,24-/m1/s1
C24H35NO5417.53842200
62415823

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+/t16-,17-,18-,19+,20-,22+,24-/m1/s1
C24H35NO5417.53841100
62583963

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+/t16-,17-,18+,19+,20-,22+,24-/m1/s1
C24H35NO5417.53841100
62583970

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11-/t16-,17-,18-,19-,20+,22+,24+/m0/s1
C24H35NO5417.53841100
62679672

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8-,14-11-/t16-,17-,18-,19-,20+,22+,24+/m0/s1
C24H35NO5417.53841100
64849560

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8-,14-11-/t16-,17+,18?,19+,20-,22+,24-/m1/s1
C24H35NO5417.53841200
79942219

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8-,14-11-/t16-,17-,18?,19+,20-,22+,24-/m1/s1
C24H35NO5417.53841100
80795726

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8-,14-11-/t16-,17-,18?,19-,20+,22+,24+/m0/s1
C24H35NO5417.53841200
13101940

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11u
C24H35NO5417.53841100
13107338

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11u/t16-,17-,18-,19-,20+,22-,24+/m0/s1
C24H35NO5417.53841100
30797273

Double-bond stereo

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+/t16-,17+,18+,19?,20-,22+,24-/m1/s1
C24H35NO5417.53841100
30797274

Double-bond stereo

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C24H35NO5/c1-13(2)10-18-22-16(5)15(4)12-17-11-14(3)6-7-19(26)20(27)8-9-21(28)30-24(17,22)23(29)25-18/h8-9,11-13,16-20,22,26-27H,6-7,10H2,1-5H3,(H,25,29)/b9-8+,14-11+/t16-,17+,18+,19-,20-,22+,24-/m1/s1
C24H35NO5417.53841100

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