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: KPBCWNNDNIGIQA (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2664504

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H31N3O3/c1-2-24-18(23)20-12-7-16(8-13-20)21-11-5-6-15(14-21)17(22)19-9-3-4-10-19/h15-16H,2-14H2,1H3
C18H31N3O3337.457161100
661711

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H31N3O3/c1-2-24-18(23)20-12-7-16(8-13-20)21-11-5-6-15(14-21)17(22)19-9-3-4-10-19/h15-16H,2-14H2,1H3/t15-/m1/s1
C18H31N3O3337.4572100
661712

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H31N3O3/c1-2-24-18(23)20-12-7-16(8-13-20)21-11-5-6-15(14-21)17(22)19-9-3-4-10-19/h15-16H,2-14H2,1H3/t15-/m0/s1
C18H31N3O3337.4572100
2664503

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C18H31N3O3/c1-2-24-18(23)20-12-7-16(8-13-20)21-11-5-6-15(14-21)17(22)19-9-3-4-10-19/h15-16H,2-14H2,1H3/p+1
C18H32N3O3338.46441100
5311714

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H31N3O3/c1-2-24-18(23)20-12-7-16(8-13-20)21-11-5-6-15(14-21)17(22)19-9-3-4-10-19/h15-16H,2-14H2,1H3/p+1/t15-/m1/s1
C18H32N3O3338.464981100
5311715

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C18H31N3O3/c1-2-24-18(23)20-12-7-16(8-13-20)21-11-5-6-15(14-21)17(22)19-9-3-4-10-19/h15-16H,2-14H2,1H3/p+1/t15-/m0/s1
C18H32N3O3338.464981100

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