propan-2-yl 4-[[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: propan-2-yl 4-[[(3S)-5-oxidanylidene-1-phenyl-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: isopropyl 4-[[(3S)-5-oxo-1-phenyl-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[(3S)-5-oxo-1-phenyl-3-pyrrolidinyl]methyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[(3S)-5-oxo-1-phenylpyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 4-[[(3S)-5-keto-1-phenyl-pyrrolidine-3-carbonyl]amino]benzoic acid isopropyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)OC(=O)C1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)N(C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-14(2)27-21(26)15-8-10-17(11-9-15)22-20(25)16-12-19(24)23(13-16)18-6-4-3-5-7-18/h3-11,14,16H,12-13H2,1-2H3,(H,22,25)/t16-/m0/s1