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

Systemtic Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methyl-phenyl]-5-(methylcarbamoyl)benzoic acid Openeye Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methyl-phenyl]-5-(methylcarbamoyl)benzoic acid CAS Name: 2-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-methylphenyl]-5-(methylcarbamoyl)benzoic acid IUPAC Name: 2-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methylphenyl]-5-(methylcarbamoyl)benzoic acid Traditional Name: 2-[2-[(4-amidinophenyl)carbamoyl]-4-methyl-phenyl]-5-(methylcarbamoyl)benzoic acid Formula: C24H22N4O4 MolecularWeight: 430.45588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NC)C(=O)O)C(=O)NC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C(C=C(C=C2)C(=O)NC)C(=O)O)C(=O)NC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H22N4O4/c1-13-3-9-17(18-10-6-15(22(29)27-2)12-20(18)24(31)32)19(11-13)23(30)28-16-7-4-14(5-8-16)21(25)26/h3-12H,1-2H3,(H3,25,26)(H,27,29)(H,28,30)(H,31,32)