3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-5-methoxy-phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylic acid

Systemtic Name: 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-5-methoxy-phenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylic acid Openeye Name: 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-5-methoxy-4-vinyl-phenyl]-6-(isobutylcarbamoyl)pyridine-2-carboxylic acid CAS Name: 3-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-ethenyl-5-methoxyphenyl]-6-[(2-methylpropylamino)-oxomethyl]-2-pyridinecarboxylic acid IUPAC Name: 3-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-ethenyl-5-methoxyphenyl]-6-(2-methylpropylcarbamoyl)pyridine-2-carboxylic acid Traditional Name: 3-[2-[(4-amidinophenyl)carbamoyl]-5-methoxy-4-vinyl-phenyl]-6-(isobutylcarbamoyl)picolinic acid Formula: C28H29N5O5 MolecularWeight: 515.56036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H29N5O5/c1-5-16-12-21(26(34)32-18-8-6-17(7-9-18)25(29)30)20(13-23(16)38-4)19-10-11-22(33-24(19)28(36)37)27(35)31-14-15(2)3/h5-13,15H,1,14H2,2-4H3,(H3,29,30)(H,31,35)(H,32,34)(H,36,37)