methyl 3-[(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)carbamoyl]benzoate

Systemtic Name: methyl 3-[(5-oxidanylidene-1-phenethyl-pyrrolidin-3-yl)carbamoyl]benzoate Openeye Name: methyl 3-[(5-oxo-1-phenethyl-pyrrolidin-3-yl)carbamoyl]benzoate CAS Name: 3-[oxo-[(5-oxo-1-phenethyl-3-pyrrolidinyl)amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-oxo-1-phenethylpyrrolidin-3-yl)carbamoyl]benzoate Traditional Name: 3-[(5-keto-1-phenethyl-pyrrolidin-3-yl)carbamoyl]benzoic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C(=O)NC2CC(=O)N(C2)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C(=O)NC2CC(=O)N(C2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O4/c1-27-21(26)17-9-5-8-16(12-17)20(25)22-18-13-19(24)23(14-18)11-10-15-6-3-2-4-7-15/h2-9,12,18H,10-11,13-14H2,1H3,(H,22,25)