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

Systemtic Name: 3-[[3-[(3-carbamimidoylphenyl)carbonylamino]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3-[(3-carbamimidoylbenzoyl)amino]benzoyl]amino]propanoic acid CAS Name: 3-[[[3-[[(3-carbamimidoylphenyl)-oxomethyl]amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3-[(3-carbamimidoylbenzoyl)amino]benzoyl]amino]propanoic acid Traditional Name: 3-[[3-[(3-amidinobenzoyl)amino]benzoyl]amino]propionic acid Formula: C18H18N4O4 MolecularWeight: 354.35992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=CC=CC(=C2)C(=O)NCCC(=O)O)C(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=CC=CC(=C2)C(=O)NCCC(=O)O)C(=N)N

InChI

InChI=1S/C18H18N4O4/c19-16(20)11-3-1-4-12(9-11)18(26)22-14-6-2-5-13(10-14)17(25)21-8-7-15(23)24/h1-6,9-10H,7-8H2,(H3,19,20)(H,21,25)(H,22,26)(H,23,24)