Vitas-M small molecule compound

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

Catalog ID
STK364293
SMILES COc1ccc(c(c1)OC)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 C24H29NO5 MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29NO5/c1-14-21(24(27)30-15-7-4-5-8-15)22(23-18(25-14)9-6-10-19(23)26)17-12-11-16(28-2)13-20(17)29-3/h11-13,15,22,25H,4-10H2,1-3H3
InChIKey
BXJHGDJDSVBNKR-UHFFFAOYSA-N
Synonyms

CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C=C(C=C3)OC)OC)C(=O)OC4CCCC4
cyclopentyl4(24dimethoxyphenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
cyclopentyl4(24dimethoxyphenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC24H29NO5c11421(24(27)3015745815)22(2318(2514)961019(23)26)17121116(282)1320(17)293h1113152225H410H213H3
MFCD00771153
ZINC000003098451
ZINC000003098452

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Available files

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