Vitas-M small molecule compound
dimethyl 5-{[(2,5-dioxo-1,2,3,4,5,6,7,8-octahydroquinolin-4-yl)carbonyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STL436020
SMILES COC(=O)c1cc(NC(=O)C2CC(=O)NC3=C2C(=O)CCC3)cc(c1)C(=O)OC
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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 C20H20N2O7 MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O7/c1-28-19(26)10-6-11(20(27)29-2)8-12(7-10)21-18(25)13-9-16(24)22-14-4-3-5-15(23)17(13)14/h6-8,13H,3-5,9H2,1-2H3,(H,21,25)(H,22,24)InChIKey
CLLOJAODIBFIQA-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC(=CC(=C1)NC(=O)C2CC(=O)NC3=C2C(=O)CCC3)C(=O)OC
dimethyl5(((25dioxo12345678octahydroquinolin4yl)carbonyl)amino)benzene13dicarboxylate
dimethyl5((25dioxo134678hexahydroquinoline4carbonyl)amino)benzene13dicarboxylate
InChI=1SC20H20N2O7c12819(26)10611(20(27)292)812(710)2118(25)13916(24)221443515(23)17(13)14h6813H359H212H3(H2125)(H2224)
MFCD06611939
ZINC000002355294
ZINC000004487067
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