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: ACWAYFMZDLIQJO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2995949

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C19H21F3N2O4S/c1-3-28-17(25)18(19(20,21)22,23-13-15-7-5-4-6-8-15)24-29(26,27)16-11-9-14(2)10-12-16/h4-12,23-24H,3,13H2,1-2H3
C19H21F3N2O4S430.4412496131200
1481767

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H21F3N2O4S/c1-3-28-17(25)18(19(20,21)22,23-13-15-7-5-4-6-8-15)24-29(26,27)16-11-9-14(2)10-12-16/h4-12,23-24H,3,13H2,1-2H3/t18-/m0/s1
C19H21F3N2O4S430.44122100
1481769

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H21F3N2O4S/c1-3-28-17(25)18(19(20,21)22,23-13-15-7-5-4-6-8-15)24-29(26,27)16-11-9-14(2)10-12-16/h4-12,23-24H,3,13H2,1-2H3/t18-/m1/s1
C19H21F3N2O4S430.44122100
1481766

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H21F3N2O4S/c1-3-28-17(25)18(19(20,21)22,23-13-15-7-5-4-6-8-15)24-29(26,27)16-11-9-14(2)10-12-16/h4-12,23-24H,3,13H2,1-2H3/p+1/t18-/m1/s1
C19H22F3N2O4S431.44861100
1481768

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C19H21F3N2O4S/c1-3-28-17(25)18(19(20,21)22,23-13-15-7-5-4-6-8-15)24-29(26,27)16-11-9-14(2)10-12-16/h4-12,23-24H,3,13H2,1-2H3/p+1/t18-/m0/s1
C19H22F3N2O4S431.44861100

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