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

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(carboxymethylcarbamoyl)phenyl]benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(carboxymethylcarbamoyl)phenyl]benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-[(carboxymethylamino)-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-(carboxymethylcarbamoyl)phenyl]benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-4-(carboxymethylcarbamoyl)phenyl]benzoic acid Formula: C24H20N4O6 MolecularWeight: 460.4388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20N4O6/c25-21(26)13-5-8-15(9-6-13)28-23(32)19-11-14(22(31)27-12-20(29)30)7-10-17(19)16-3-1-2-4-18(16)24(33)34/h1-11H,12H2,(H3,25,26)(H,27,31)(H,28,32)(H,29,30)(H,33,34)