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
Additional Filters

Found 5 results

Search term: WGFZEBCCQNOPOO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
21692652

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H22N2O3S/c1-13(21(2)11-14-4-7-16(25-3)8-5-14)19(22)20-15-6-9-17-18(10-15)24-12-23-17/h4-10,13H,11-12H2,1-3H3,(H,20,22)
C19H22N2O3S358.45469700
6665397

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2O3S/c1-13(21(2)11-14-4-7-16(25-3)8-5-14)19(22)20-15-6-9-17-18(10-15)24-12-23-17/h4-10,13H,11-12H2,1-3H3,(H,20,22)/t13-/m0/s1
C19H22N2O3S358.45462100
6665399

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2O3S/c1-13(21(2)11-14-4-7-16(25-3)8-5-14)19(22)20-15-6-9-17-18(10-15)24-12-23-17/h4-10,13H,11-12H2,1-3H3,(H,20,22)/t13-/m1/s1
C19H22N2O3S358.45462100
6665396

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2O3S/c1-13(21(2)11-14-4-7-16(25-3)8-5-14)19(22)20-15-6-9-17-18(10-15)24-12-23-17/h4-10,13H,11-12H2,1-3H3,(H,20,22)/p+1/t13-/m0/s1
C19H23N2O3S359.4621100
6665398

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H22N2O3S/c1-13(21(2)11-14-4-7-16(25-3)8-5-14)19(22)20-15-6-9-17-18(10-15)24-12-23-17/h4-10,13H,11-12H2,1-3H3,(H,20,22)/p+1/t13-/m1/s1
C19H23N2O3S359.4621100

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