1-[(3-carbamimidoylphenyl)methyl]-N-[(3,5-dimethoxyphenyl)methyl]-4-oxidanyl-indole-2-carboxamide

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3,5-dimethoxyphenyl)methyl]-4-oxidanyl-indole-2-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3,5-dimethoxyphenyl)methyl]-4-hydroxy-indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3,5-dimethoxyphenyl)methyl]-4-hydroxy-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(3,5-dimethoxyphenyl)methyl]-4-hydroxyindole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-N-(3,5-dimethoxybenzyl)-4-hydroxy-indole-2-carboxamide Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC=C3O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC=C3O)OC

InChI

InChI=1S/C26H26N4O4/c1-33-19-10-17(11-20(12-19)34-2)14-29-26(32)23-13-21-22(7-4-8-24(21)31)30(23)15-16-5-3-6-18(9-16)25(27)28/h3-13,31H,14-15H2,1-2H3,(H3,27,28)(H,29,32)