dimethyl 2-[(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[(5-oxidanylidene-1-phenyl-pyrrolidin-3-yl)carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[(5-oxo-1-phenyl-pyrrolidine-3-carbonyl)amino]benzene-1,4-dicarboxylate CAS Name: 2-[[oxo-(5-oxo-1-phenyl-3-pyrrolidinyl)methyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(5-oxo-1-phenylpyrrolidine-3-carbonyl)amino]benzene-1,4-dicarboxylate Traditional Name: 2-[(5-keto-1-phenyl-pyrrolidine-3-carbonyl)amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6/c1-28-20(26)13-8-9-16(21(27)29-2)17(10-13)22-19(25)14-11-18(24)23(12-14)15-6-4-3-5-7-15/h3-10,14H,11-12H2,1-2H3,(H,22,25)