4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methoxy-phenyl]-N1-(2-methylpropyl)-N3-oxidanyl-benzene-1,3-dicarboxamide

Systemtic Name: 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methoxy-phenyl]-N1-(2-methylpropyl)-N3-oxidanyl-benzene-1,3-dicarboxamide Openeye Name: 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methoxy-phenyl]-3-(hydroxycarbamoyl)-N-isobutyl-benzamide CAS Name: 4-[2-[(4-carbamimidoylanilino)-oxomethyl]-4-methoxyphenyl]-N3-hydroxy-N1-(2-methylpropyl)benzene-1,3-dicarboxamide IUPAC Name: 4-[2-[(4-carbamimidoylphenyl)carbamoyl]-4-methoxyphenyl]-3-N-hydroxy-1-N-(2-methylpropyl)benzene-1,3-dicarboxamide Traditional Name: 4-[2-[(4-amidinophenyl)carbamoyl]-4-methoxy-phenyl]-3-(hydroxycarbamoyl)-N-isobutyl-benzamide Formula: C27H29N5O5 MolecularWeight: 503.54966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)NO

Isomeric SMILES

CC(C)CNC(=O)C1=CC(=C(C=C1)C2=C(C=C(C=C2)OC)C(=O)NC3=CC=C(C=C3)C(=N)N)C(=O)NO

InChI

InChI=1S/C27H29N5O5/c1-15(2)14-30-25(33)17-6-10-20(22(12-17)27(35)32-36)21-11-9-19(37-3)13-23(21)26(34)31-18-7-4-16(5-8-18)24(28)29/h4-13,15,36H,14H2,1-3H3,(H3,28,29)(H,30,33)(H,31,34)(H,32,35)