2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-carboxyethylcarbamoyl)benzoic acid

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-carboxyethylcarbamoyl)benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-carboxyethylcarbamoyl)benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-5-[(2-carboxyethylamino)-oxomethyl]benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-5-(2-carboxyethylcarbamoyl)benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]phenyl]-5-(2-carboxyethylcarbamoyl)benzoic acid Formula: C25H22N4O6 MolecularWeight: 474.46538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=C(C=C(C=C2)C(=O)NCCC(=O)O)C(=O)O)C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

C1=CC=C(C(=C1)C2=C(C=C(C=C2)C(=O)NCCC(=O)O)C(=O)O)C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H22N4O6/c26-22(27)14-5-8-16(9-6-14)29-24(33)19-4-2-1-3-17(19)18-10-7-15(13-20(18)25(34)35)23(32)28-12-11-21(30)31/h1-10,13H,11-12H2,(H3,26,27)(H,28,32)(H,29,33)(H,30,31)(H,34,35)