Matches any text strings used to describe a molecule.
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
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Found 28 results

Search term: WRWBCPJQPDHXTJ (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
199375

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16-,17-,18-,19-,20-/m0/s1
C20H32O2304.466955621738
10186

1 of 7 defined stereocentres - 1/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14?,15?,16?,17?,18?,19?,20-/m0/s1
C20H32O2304.466910800
7972260

4 of 7 defined stereocentres - 4/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15?,16?,17?,18-,19-,20-/m0/s1
C20H32O2304.46699800
17466852

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16?,17?,18-,19-,20-/m0/s1
C20H32O2304.46698400
48063731

7 of 7 defined stereocentres - 7/7 defined

Non-standard isotope
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16-,17-,18-,19-,20-/m0/s1/i3D3
C20H29D3O2307.48546700
10043858

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15-,16+,17+,18-,19-,20-/m0/s1
C20H32O2304.46695400
10043857

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15-,16-,17+,18-,19-,20-/m0/s1
C20H32O2304.46693100
20035327

5 of 7 defined stereocentres - 5/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14?,15-,16+,17+,18+,19+,20?/m1/s1
C20H32O2304.46693300
4935221

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15?,16?,17?,18?,19?,20+/m0/s1
C20H32O2304.46693300
4937760

2 of 7 defined stereocentres - 2/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15?,16?,17?,18?,19?,20-/m0/s1
C20H32O2304.46693400
5442148

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16+,17+,18-,19-,20-/m0/s1
C20H32O2304.46693200
5442149

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16-,17+,18-,19-,20-/m0/s1
C20H32O2304.46692100
5416938

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16+,17-,18-,19-,20-/m0/s1
C20H32O2304.46692100
1264796

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16-,17+,18-,19+,20-/m1/s1
C20H32O2304.46692100
1363662

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15-,16-,17-,18-,19+,20-/m1/s1
C20H32O2304.46692100
1412906

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16-,17-,18-,19+,20-/m1/s1
C20H32O2304.46692100
1412907

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16+,17-,18-,19+,20-/m1/s1
C20H32O2304.46692100
1412908

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16+,17+,18-,19+,20-/m1/s1
C20H32O2304.46692100
52563780

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16+,17+,18-,19-,20+/m0/s1
C20H32O2304.46692300
78219359

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C20H32O2/c1-18-9-6-14(21)12-13(18)4-5-15-16(18)7-10-19(2)17(15)8-11-20(19,3)22/h4,14-17,21-22H,5-12H2,1-3H3/t14-,15+,16-,17-,18-,19-,20-/m1/s1
C20H32O2304.46692200
12

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