Vitas-M small molecule compound

N-(4-acetylphenyl)-7,7-dimethyl-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-4-carboxamide

Catalog ID
STK217542
SMILES O=C1NC2=C(C(C1)C(=O)Nc1ccc(cc1)C(=O)C)C(=O)CC(C2)(C)C

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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 C20H22N2O4 MW 354.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O4/c1-11(23)12-4-6-13(7-5-12)21-19(26)14-8-17(25)22-15-9-20(2,3)10-16(24)18(14)15/h4-7,14H,8-10H2,1-3H3,(H,21,26)(H,22,25)
InChIKey
NLUZQSHNQGGMGA-UHFFFAOYSA-N
Synonyms
774562-77-5
774562775
CC(=O)C1=CC=C(C=C1)NC(=O)C2CC(=O)NC3=C2C(=O)CC(C3)(C)C
InChI=1SC20H22N2O4c111(23)124613(7512)2119(26)14817(25)2215920(23)1016(24)18(14)15h4714H810H213H3(H2126)(H2225)
MFCD06612236
N(4acetylphenyl)77dimethyl25dioxo12345678octahydroquinoline4carboxamide
N(4acetylphenyl)77dimethyl25dioxo3468tetrahydro1Hquinoline4carboxamide
ZINC000100257141

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Available files

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