Vitas-M small molecule compound
benzyl 4-(3,4-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK372447
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)Cl)C(=O)CCC2)OCc1ccccc1
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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 C24H21Cl2NO3 MW 442.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2NO3/c1-14-21(24(29)30-13-15-6-3-2-4-7-15)22(16-10-11-17(25)18(26)12-16)23-19(27-14)8-5-9-20(23)28/h2-4,6-7,10-12,22,27H,5,8-9,13H2,1H3InChIKey
OIKKHQBJFZQQSO-UHFFFAOYSA-NSynonyms
benzyl4(34dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
benzyl4(34dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)Cl)Cl)C(=O)OCC4=CC=CC=C4
InChI=1SC24H21Cl2NO3c11421(24(29)3013156324715)22(16101117(25)18(26)1216)2319(2714)85920(23)28h246710122227H58913H21H3
MFCD00771237
ZINC000019855105
ZINC000019855107
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