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: ZCKHNZPCAFCCFN (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
7852598

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C18H17N7O5S2/c1-24-18(20-22-23-24)32-8-10-7-31-16-12(15(27)25(16)13(10)17(28)29)19-14(26)11(21-30)9-5-3-2-4-6-9/h2-6,12,16,30H,7-8H2,1H3,(H,19,26)(H,28,29)/b21-11+/t12-,16-/m1/s1
C18H17N7O5S2475.50153300
64883426

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H17N7O5S2/c1-24-18(20-22-23-24)32-8-10-7-31-16-12(15(27)25(16)13(10)17(28)29)19-14(26)11(21-30)9-5-3-2-4-6-9/h2-6,12,16,30H,7-8H2,1H3,(H,19,26)(H,28,29)/b21-11+
C18H17N7O5S2475.50151100
120327314

Double-bond stereo

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C18H17N7O5S2/c1-24-18(20-22-23-24)32-8-10-7-31-16-12(15(27)25(16)13(10)17(28)29)19-14(26)11(21-30)9-5-3-2-4-6-9/h2-6,12,16,30H,7-8H2,1H3,(H,19,26)(H,28,29)
C18H17N7O5S2475.50151100

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