(2-cyanophenyl)methyl 2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]carbonylamino]ethanoate Openeye Name: (2-cyanophenyl)methyl 2-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]amino]acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-[[4-(2-oxopyrrolidin-1-yl)benzoyl]amino]acetate Traditional Name: 2-[[4-(2-ketopyrrolidino)benzoyl]amino]acetic acid (2-cyanobenzyl) ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)NCC(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)C(=O)NCC(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C21H19N3O4/c22-12-16-4-1-2-5-17(16)14-28-20(26)13-23-21(27)15-7-9-18(10-8-15)24-11-3-6-19(24)25/h1-2,4-5,7-10H,3,6,11,13-14H2,(H,23,27)