Vitas-M small molecule compound

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

Catalog ID
STK407187
SMILES Cc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CCC2)C(=O)OC1CCCC1

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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 C23H27NO3 MW 365.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27NO3/c1-14-10-12-16(13-11-14)21-20(23(26)27-17-6-3-4-7-17)15(2)24-18-8-5-9-19(25)22(18)21/h10-13,17,21,24H,3-9H2,1-2H3
InChIKey
MBMRHTHVACFMKN-UHFFFAOYSA-N
Synonyms
299453-17-1
299453171
CC1=CC=C(C=C1)C2C3=C(CCCC3=O)NC(=C2C(=O)OC4CCCC4)C
cyclopentyl2methyl4(4methylphenyl)5oxo145678hexahydroquinoline3carboxylate
cyclopentyl2methyl4(4methylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC23H27NO3c114101216(131114)2120(23(26)2717634717)15(2)241885919(25)22(18)21h1013172124H39H212H3
MFCD00717854
ZINC000003905772
ZINC000003905773

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Available files

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