Vitas-M small molecule compound

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

Catalog ID
STK060426
SMILES CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CCC2

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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 C20H22ClNO3 MW 359.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22ClNO3/c1-3-11-25-20(24)17-12(2)22-15-9-6-10-16(23)19(15)18(17)13-7-4-5-8-14(13)21/h4-5,7-8,18,22H,3,6,9-11H2,1-2H3
InChIKey
RUAXDJSLCHBUCX-UHFFFAOYSA-N
Synonyms
299451-96-0
299451960
CCCOC(=O)C1=C(C)NC2=C(C1c1ccccc1Cl)C(=O)CCC2
CCCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3Cl)C(=O)CCC2)C
InChI=1SC20H22ClNO3c13112520(24)1712(2)2215961016(23)19(15)18(17)13745814(13)21h45781822H36911H212H3
MFCD00717847
propyl4(2chlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
propyl4(2chlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK060426
ZINC000002055081
ZINC000002055082

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Available files

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