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

Systemtic Name: 3-(4-benzamidophenyl)-2-[(4-methoxyphenyl)methyl-(5-oxidanylidenepyrrolidin-2-yl)carbonyl-amino]propanoic acid Openeye Name: 3-(4-benzamidophenyl)-2-[(4-methoxyphenyl)methyl-(5-oxopyrrolidine-2-carbonyl)amino]propanoic acid CAS Name: 3-(4-benzamidophenyl)-2-[(4-methoxyphenyl)methyl-[oxo-(5-oxo-2-pyrrolidinyl)methyl]amino]propanoic acid IUPAC Name: 3-(4-benzamidophenyl)-2-[(4-methoxyphenyl)methyl-(5-oxopyrrolidine-2-carbonyl)amino]propanoic acid Traditional Name: 3-(4-benzamidophenyl)-2-[p-anisyl(pyroglutamoyl)amino]propionic acid Formula: C29H29N3O6 MolecularWeight: 515.55706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(C(CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)O)C(=O)C4CCC(=O)N4

Isomeric SMILES

COC1=CC=C(C=C1)CN(C(CC2=CC=C(C=C2)NC(=O)C3=CC=CC=C3)C(=O)O)C(=O)C4CCC(=O)N4

InChI

InChI=1S/C29H29N3O6/c1-38-23-13-9-20(10-14-23)18-32(28(35)24-15-16-26(33)31-24)25(29(36)37)17-19-7-11-22(12-8-19)30-27(34)21-5-3-2-4-6-21/h2-14,24-25H,15-18H2,1H3,(H,30,34)(H,31,33)(H,36,37)