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 6 results

Search term: ITPCPUZQSFRMJO (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
172173

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H18N2O/c1-21-13-8-6-12(7-9-13)17-18-15(10-11-19-17)14-4-2-3-5-16(14)20-18/h2-9,17,19-20H,10-11H2,1H3
C18H18N2O278.3483593800
673762

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18N2O/c1-21-13-8-6-12(7-9-13)17-18-15(10-11-19-17)14-4-2-3-5-16(14)20-18/h2-9,17,19-20H,10-11H2,1H3/t17-/m0/s1
C18H18N2O278.34835300
673764

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18N2O/c1-21-13-8-6-12(7-9-13)17-18-15(10-11-19-17)14-4-2-3-5-16(14)20-18/h2-9,17,19-20H,10-11H2,1H3/t17-/m1/s1
C18H18N2O278.34833100
3813303

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H18N2O/c1-21-13-8-6-12(7-9-13)17-18-15(10-11-19-17)14-4-2-3-5-16(14)20-18/h2-9,17,19-20H,10-11H2,1H3/p+1
C18H19N2O279.35571100
5314919

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18N2O/c1-21-13-8-6-12(7-9-13)17-18-15(10-11-19-17)14-4-2-3-5-16(14)20-18/h2-9,17,19-20H,10-11H2,1H3/p+1/t17-/m0/s1
C18H19N2O279.356261100
5314921

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H18N2O/c1-21-13-8-6-12(7-9-13)17-18-15(10-11-19-17)14-4-2-3-5-16(14)20-18/h2-9,17,19-20H,10-11H2,1H3/p+1/t17-/m1/s1
C18H19N2O279.356261100

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