3-[[3-[[(4-carbamimidoylphenyl)carbonylamino]methyl]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-[[(4-carbamimidoylphenyl)carbonylamino]methyl]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3-[[(4-carbamimidoylbenzoyl)amino]methyl]benzoyl]amino]propanoic acid CAS Name: 3-[[[3-[[[(4-carbamimidoylphenyl)-oxomethyl]amino]methyl]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3-[[(4-carbamimidoylbenzoyl)amino]methyl]benzoyl]amino]propanoic acid Traditional Name: 3-[[3-[[(4-amidinobenzoyl)amino]methyl]benzoyl]amino]propionic acid Formula: C19H20N4O4 MolecularWeight: 368.3865

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)CNC(=O)C2=CC=C(C=C2)C(=N)N)C(=O)NCCC(=O)O

InChI

InChI=1S/C19H20N4O4/c20-17(21)13-4-6-14(7-5-13)18(26)23-11-12-2-1-3-15(10-12)19(27)22-9-8-16(24)25/h1-7,10H,8-9,11H2,(H3,20,21)(H,22,27)(H,23,26)(H,24,25)