6-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[2-[(4-carbamimidoylanilino)-oxomethyl]phenyl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[2-[(4-carbamimidoylphenyl)carbamoyl]phenyl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[2-[(4-amidinophenyl)carbamoyl]phenyl]-2,3-dimethoxy-benzoic acid Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)O)OC

InChI

InChI=1S/C23H21N3O5/c1-30-18-12-11-16(19(23(28)29)20(18)31-2)15-5-3-4-6-17(15)22(27)26-14-9-7-13(8-10-14)21(24)25/h3-12H,1-2H3,(H3,24,25)(H,26,27)(H,28,29)