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

Systemtic Name: dimethyl 5-[[4-[(2-oxidanylidenepyrrolidin-1-yl)methyl]phenyl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[oxo-[4-[(2-oxo-1-pyrrolidinyl)methyl]phenyl]methyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[4-[(2-oxopyrrolidin-1-yl)methyl]benzoyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[4-[(2-ketopyrrolidino)methyl]benzoyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)CN3CCCC3=O)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)CN3CCCC3=O)C(=O)OC

InChI

InChI=1S/C22H22N2O6/c1-29-21(27)16-10-17(22(28)30-2)12-18(11-16)23-20(26)15-7-5-14(6-8-15)13-24-9-3-4-19(24)25/h5-8,10-12H,3-4,9,13H2,1-2H3,(H,23,26)