3-(4-benzamidophenyl)-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonyl-(phenylmethyl)amino]propanoic acid

Systemtic Name: 3-(4-benzamidophenyl)-2-[(5-oxidanylidenepyrrolidin-2-yl)carbonyl-(phenylmethyl)amino]propanoic acid Openeye Name: 3-(4-benzamidophenyl)-2-[benzyl-(5-oxopyrrolidine-2-carbonyl)amino]propanoic acid CAS Name: 3-(4-benzamidophenyl)-2-[[oxo-(5-oxo-2-pyrrolidinyl)methyl]-(phenylmethyl)amino]propanoic acid IUPAC Name: 3-(4-benzamidophenyl)-2-[benzyl-(5-oxopyrrolidine-2-carbonyl)amino]propanoic acid Traditional Name: 3-(4-benzamidophenyl)-2-[benzyl(pyroglutamoyl)amino]propionic acid Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NC1C(=O)N(CC2=CC=CC=C2)C(CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(=O)NC1C(=O)N(CC2=CC=CC=C2)C(CC3=CC=C(C=C3)NC(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H27N3O5/c32-25-16-15-23(30-25)27(34)31(18-20-7-3-1-4-8-20)24(28(35)36)17-19-11-13-22(14-12-19)29-26(33)21-9-5-2-6-10-21/h1-14,23-24H,15-18H2,(H,29,33)(H,30,32)(H,35,36)