Vitas-M small molecule compound

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

Catalog ID
STK404269
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)Cl)C(=O)CC(C2)c1ccco1

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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 C22H20ClNO4 MW 397.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO4/c1-12-19(22(26)27-2)20(13-5-7-15(23)8-6-13)21-16(24-12)10-14(11-17(21)25)18-4-3-9-28-18/h3-9,14,20,24H,10-11H2,1-2H3
InChIKey
MUBGRJCTQFIUBZ-UHFFFAOYSA-N
Synonyms
669735-14-2
669735142
CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CO3)C4=CC=C(C=C4)Cl)C(=O)OC
InChI=1SC22H20ClNO4c11219(22(26)272)20(135715(23)8613)2116(2412)1014(1117(21)25)184392818h39142024H1011H212H3
methyl4(4chlorophenyl)7(furan2yl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl4(4chlorophenyl)7(furan2yl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD03854929
ZINC000019856860
ZINC000019856866

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Available files

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