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 6 results

Search term: JYNFDLBSWDIVNR (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2200259

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C19H22N2O3S/c1-15(16-9-4-2-5-10-16)20-19(22)18-13-8-14-21(18)25(23,24)17-11-6-3-7-12-17/h2-7,9-12,15,18H,8,13-14H2,1H3,(H,20,22)
C19H22N2O3S358.45458291900
5025226

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H22N2O3S/c1-15(16-9-4-2-5-10-16)20-19(22)18-13-8-14-21(18)25(23,24)17-11-6-3-7-12-17/h2-7,9-12,15,18H,8,13-14H2,1H3,(H,20,22)/t15-,18-/m0/s1
C19H22N2O3S358.45462100
5614846

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H22N2O3S/c1-15(16-9-4-2-5-10-16)20-19(22)18-13-8-14-21(18)25(23,24)17-11-6-3-7-12-17/h2-7,9-12,15,18H,8,13-14H2,1H3,(H,20,22)/t15-,18-/m1/s1
C19H22N2O3S358.45462100
858131

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H22N2O3S/c1-15(16-9-4-2-5-10-16)20-19(22)18-13-8-14-21(18)25(23,24)17-11-6-3-7-12-17/h2-7,9-12,15,18H,8,13-14H2,1H3,(H,20,22)/t15-,18+/m1/s1
C19H22N2O3S358.45462100
1035960

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C19H22N2O3S/c1-15(16-9-4-2-5-10-16)20-19(22)18-13-8-14-21(18)25(23,24)17-11-6-3-7-12-17/h2-7,9-12,15,18H,8,13-14H2,1H3,(H,20,22)/t15-,18+/m0/s1
C19H22N2O3S358.45462100
69729016

1 of 2 defined stereocentres - 1/2 defined
InChI=1/C19H22N2O3S/c1-15(16-9-4-2-5-10-16)20-19(22)18-13-8-14-21(18)25(23,24)17-11-6-3-7-12-17/h2-7,9-12,15,18H,8,13-14H2,1H3,(H,20,22)/t15?,18-/m1/s1
C19H22N2O3S358.45461100

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