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 3 results

Search term: MDFVQZLNRBIHTH (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2072257

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C20H22N4O4S/c1-11-4-6-13-16(8-11)29-19-18(13)20(26)24(23-22-19)10-17(25)21-14-9-12(27-2)5-7-15(14)28-3/h5,7,9,11H,4,6,8,10H2,1-3H3,(H,21,25)
C20H22N4O4S414.47808231400
860175

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H22N4O4S/c1-11-4-6-13-16(8-11)29-19-18(13)20(26)24(23-22-19)10-17(25)21-14-9-12(27-2)5-7-15(14)28-3/h5,7,9,11H,4,6,8,10H2,1-3H3,(H,21,25)/t11-/m0/s1
C20H22N4O4S414.47812100
860176

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C20H22N4O4S/c1-11-4-6-13-16(8-11)29-19-18(13)20(26)24(23-22-19)10-17(25)21-14-9-12(27-2)5-7-15(14)28-3/h5,7,9,11H,4,6,8,10H2,1-3H3,(H,21,25)/t11-/m1/s1
C20H22N4O4S414.47812100

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