Vitas-M small molecule compound

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

Catalog ID
STK407252
SMILES COC(=O)C1=C(C)NC2=C(C1c1ccccc1OC)C(=O)CC(C2)c1ccccc1Cl

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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 C25H24ClNO4 MW 437.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClNO4/c1-14-22(25(29)31-3)23(17-9-5-7-11-21(17)30-2)24-19(27-14)12-15(13-20(24)28)16-8-4-6-10-18(16)26/h4-11,15,23,27H,12-13H2,1-3H3
InChIKey
PAGRLAYEIJBNRK-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CC=C3Cl)C4=CC=CC=C4OC)C(=O)OC
InChI=1SC25H24ClNO4c11422(25(29)313)23(179571121(17)302)2419(2714)1215(1320(24)28)168461018(16)26h411152327H1213H213H3
methyl7(2chlorophenyl)4(2methoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
methyl7(2chlorophenyl)4(2methoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
MFCD01445551
ZINC000000707602
ZINC000000707605

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Available files

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