Vitas-M small molecule compound

methyl 7-methyl-4-(2-methylphenyl)-2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinoline-6-carboxylate

Catalog ID
STK406965
SMILES COC(=O)C1C(C)CC2=C(C1=O)C(CC(=O)N2)c1ccccc1C

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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 C19H21NO4 MW 327.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO4/c1-10-6-4-5-7-12(10)13-9-15(21)20-14-8-11(2)16(19(23)24-3)18(22)17(13)14/h4-7,11,13,16H,8-9H2,1-3H3,(H,20,21)
InChIKey
BKEPXBJNGPWEGT-UHFFFAOYSA-N
Synonyms

CC1CC2=C(C(CC(=O)N2)C3=CC=CC=C3C)C(=O)C1C(=O)OC
InChI=1SC19H21NO4c110645712(10)13915(21)2014811(2)16(19(23)243)18(22)17(13)14h47111316H89H213H3(H2021)
methyl7methyl4(2methylphenyl)25dioxo12345678octahydroquinoline6carboxylate
methyl7methyl4(2methylphenyl)25dioxo134678hexahydroquinoline6carboxylate
MFCD07613432
ZINC000006819984
ZINC000101992311

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Available files

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