Vitas-M small molecule compound

methyl 4-(2-chlorophenyl)-2-methyl-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK097532
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccccc1

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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 C24H22ClNO3 MW 407.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClNO3/c1-14-21(24(28)29-2)22(17-10-6-7-11-18(17)25)23-19(26-14)12-16(13-20(23)27)15-8-4-3-5-9-15/h3-11,16,22,26H,12-13H2,1-2H3
InChIKey
ORXXVDIOZMNKTL-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3)C4=CC=CC=C4Cl)C(=O)OC
COC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccccc1
InChI=1SC24H22ClNO3c11421(24(28)292)22(1710671118(17)25)2319(2614)1216(1320(23)27)158435915h311162226H1213H212H3
methyl4(2chlorophenyl)2methyl5oxo7phenyl145678hexahydroquinoline3carboxylate
methyl4(2chlorophenyl)2methyl5oxo7phenyl4678tetrahydro1Hquinoline3carboxylate
MFCD00614975
STK097532
ZINC000019867187
ZINC000019867197

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.