methyl 2-[[1-(4-acetamidophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[1-(4-acetamidophenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[1-(4-acetamidophenyl)-5-oxo-pyrrolidine-3-carbonyl]amino]benzoate CAS Name: 2-[[[1-(4-acetamidophenyl)-5-oxo-3-pyrrolidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[1-(4-acetamidophenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate Traditional Name: 2-[[1-(4-acetamidophenyl)-5-keto-pyrrolidine-3-carbonyl]amino]benzoic acid methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H21N3O5/c1-13(25)22-15-7-9-16(10-8-15)24-12-14(11-19(24)26)20(27)23-18-6-4-3-5-17(18)21(28)29-2/h3-10,14H,11-12H2,1-2H3,(H,22,25)(H,23,27)