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

Systemtic Name: 2-[3-[[(3-carbamimidoylphenyl)carbonylamino]methyl]-2-oxidanylidene-1-(3-phenylpropyl)pyrrolidin-3-yl]ethanoic acid Openeye Name: 2-[3-[[(3-carbamimidoylbenzoyl)amino]methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid CAS Name: 2-[3-[[[(3-carbamimidoylphenyl)-oxomethyl]amino]methyl]-2-oxo-1-(3-phenylpropyl)-3-pyrrolidinyl]acetic acid IUPAC Name: 2-[3-[[(3-carbamimidoylbenzoyl)amino]methyl]-2-oxo-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Traditional Name: 2-[3-[[(3-amidinobenzoyl)amino]methyl]-2-keto-1-(3-phenylpropyl)pyrrolidin-3-yl]acetic acid Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1(CC(=O)O)CNC(=O)C2=CC=CC(=C2)C(=N)N)CCCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(=O)C1(CC(=O)O)CNC(=O)C2=CC=CC(=C2)C(=N)N)CCCC3=CC=CC=C3

InChI

InChI=1S/C24H28N4O4/c25-21(26)18-9-4-10-19(14-18)22(31)27-16-24(15-20(29)30)11-13-28(23(24)32)12-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,14H,5,8,11-13,15-16H2,(H3,25,26)(H,27,31)(H,29,30)