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

Systemtic Name: dimethyl 5-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-(2-ketopyrrolidino)benzoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)N3CCCC3=O)C(=O)OC

InChI

InChI=1S/C21H20N2O6/c1-28-20(26)14-10-15(21(27)29-2)12-16(11-14)22-19(25)13-5-7-17(8-6-13)23-9-3-4-18(23)24/h5-8,10-12H,3-4,9H2,1-2H3,(H,22,25)