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: KIKLQFLDRUOEIM (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3980320

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H21ClN2O2S/c1-12-9-13(18)6-7-15(12)22-11-17(21)19-10-14(20(2)3)16-5-4-8-23-16/h4-9,14H,10-11H2,1-3H3,(H,19,21)
C17H21ClN2O2S352.878812900
6330363

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21ClN2O2S/c1-12-9-13(18)6-7-15(12)22-11-17(21)19-10-14(20(2)3)16-5-4-8-23-16/h4-9,14H,10-11H2,1-3H3,(H,19,21)/t14-/m0/s1
C17H21ClN2O2S352.87882100
6330366

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21ClN2O2S/c1-12-9-13(18)6-7-15(12)22-11-17(21)19-10-14(20(2)3)16-5-4-8-23-16/h4-9,14H,10-11H2,1-3H3,(H,19,21)/t14-/m1/s1
C17H21ClN2O2S352.87882100
6330365

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21ClN2O2S/c1-12-9-13(18)6-7-15(12)22-11-17(21)19-10-14(20(2)3)16-5-4-8-23-16/h4-9,14H,10-11H2,1-3H3,(H,19,21)/p+1/t14-/m1/s1
C17H22ClN2O2S353.88621100
6330362

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H21ClN2O2S/c1-12-9-13(18)6-7-15(12)22-11-17(21)19-10-14(20(2)3)16-5-4-8-23-16/h4-9,14H,10-11H2,1-3H3,(H,19,21)/p+1/t14-/m0/s1
C17H22ClN2O2S353.88621100

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