2-[1-[[[4-(3-carbamimidoylphenyl)phenyl]carbonylamino]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid

Systemtic Name: 2-[1-[[[4-(3-carbamimidoylphenyl)phenyl]carbonylamino]methyl]-2-oxidanylidene-pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[1-[[[4-(3-carbamimidoylphenyl)benzoyl]amino]methyl]-2-oxo-pyrrolidin-3-yl]acetic acid CAS Name: 2-[1-[[[[4-(3-carbamimidoylphenyl)phenyl]-oxomethyl]amino]methyl]-2-oxo-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[1-[[[4-(3-carbamimidoylphenyl)benzoyl]amino]methyl]-2-oxopyrrolidin-3-yl]acetic acid Traditional Name: 2-[1-[[[4-(3-amidinophenyl)benzoyl]amino]methyl]-2-keto-pyrrolidin-3-yl]acetic acid Formula: C21H22N4O4 MolecularWeight: 394.42378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1CC(=O)O)CNC(=O)C2=CC=C(C=C2)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

C1CN(C(=O)C1CC(=O)O)CNC(=O)C2=CC=C(C=C2)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C21H22N4O4/c22-19(23)16-3-1-2-15(10-16)13-4-6-14(7-5-13)20(28)24-12-25-9-8-17(21(25)29)11-18(26)27/h1-7,10,17H,8-9,11-12H2,(H3,22,23)(H,24,28)(H,26,27)