2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylcarbamoyl)phenyl]benzoic acid

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylcarbamoyl)phenyl]benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylcarbamoyl)phenyl]benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-(methylcarbamoyl)phenyl]benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(methylcarbamoyl)phenyl]benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-4-(methylcarbamoyl)phenyl]benzoic acid Formula: C23H20N4O4 MolecularWeight: 416.4293

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)O)C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CNC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2C(=O)O)C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H20N4O4/c1-26-21(28)14-8-11-17(16-4-2-3-5-18(16)23(30)31)19(12-14)22(29)27-15-9-6-13(7-10-15)20(24)25/h2-12H,1H3,(H3,24,25)(H,26,28)(H,27,29)(H,30,31)