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: RCKWVADTESWWOU (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2974902

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C24H31N3O2S/c1-15-9-10-19(17(3)12-15)25-23(29)22-18-7-4-8-20(18)30-24(22)26-21(28)14-27-11-5-6-16(2)13-27/h9-10,12,16H,4-8,11,13-14H2,1-3H3,(H,25,29)(H,26,28)
C24H31N3O2S425.58684151100
5613060

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H31N3O2S/c1-15-9-10-19(17(3)12-15)25-23(29)22-18-7-4-8-20(18)30-24(22)26-21(28)14-27-11-5-6-16(2)13-27/h9-10,12,16H,4-8,11,13-14H2,1-3H3,(H,25,29)(H,26,28)/t16-/m0/s1
C24H31N3O2S425.58682100
5613065

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H31N3O2S/c1-15-9-10-19(17(3)12-15)25-23(29)22-18-7-4-8-20(18)30-24(22)26-21(28)14-27-11-5-6-16(2)13-27/h9-10,12,16H,4-8,11,13-14H2,1-3H3,(H,25,29)(H,26,28)/t16-/m1/s1
C24H31N3O2S425.58682100
5613064

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H31N3O2S/c1-15-9-10-19(17(3)12-15)25-23(29)22-18-7-4-8-20(18)30-24(22)26-21(28)14-27-11-5-6-16(2)13-27/h9-10,12,16H,4-8,11,13-14H2,1-3H3,(H,25,29)(H,26,28)/p+1/t16-/m1/s1
C24H32N3O2S426.59421100
5613059

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C24H31N3O2S/c1-15-9-10-19(17(3)12-15)25-23(29)22-18-7-4-8-20(18)30-24(22)26-21(28)14-27-11-5-6-16(2)13-27/h9-10,12,16H,4-8,11,13-14H2,1-3H3,(H,25,29)(H,26,28)/p+1/t16-/m0/s1
C24H32N3O2S426.59421100

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