Vitas-M small molecule compound
4-(4-chlorophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK069063
SMILES N#CC1=C(C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H19ClN2O MW 326.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O/c1-11-14(10-21)17(12-4-6-13(20)7-5-12)18-15(22-11)8-19(2,3)9-16(18)23/h4-7,17,22H,8-9H2,1-3H3InChIKey
NXDSOJRUMHYGIV-UHFFFAOYSA-NSynonyms
4(4chlorophenyl)277trimethyl5oxo145678hexahydroquinoline3carbonitrile
4(4chlorophenyl)277trimethyl5oxo1468tetrahydroquinoline3carbonitrile
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)Cl)C#N
InChI=1SC19H19ClN2Oc11114(1021)17(124613(20)7512)1815(2211)819(23)916(18)23h471722H89H213H3
MFCD00785416
N#CC1=C(C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)(C)C
STK069063
ZINC000019761698
ZINC000019761700
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