1-[(3-carbamimidoylphenyl)methyl]-N-(naphthalen-2-ylmethyl)-4-oxidanyl-indole-2-carboxamide

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-N-(naphthalen-2-ylmethyl)-4-oxidanyl-indole-2-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-(2-naphthylmethyl)indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-(2-naphthalenylmethyl)-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-(naphthalen-2-ylmethyl)indole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-4-hydroxy-N-(2-naphthylmethyl)indole-2-carboxamide Formula: C28H24N4O2 MolecularWeight: 448.51576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CNC(=O)C3=CC4=C(N3CC5=CC=CC(=C5)C(=N)N)C=CC=C4O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CNC(=O)C3=CC4=C(N3CC5=CC=CC(=C5)C(=N)N)C=CC=C4O

InChI

InChI=1S/C28H24N4O2/c29-27(30)22-8-3-5-19(14-22)17-32-24-9-4-10-26(33)23(24)15-25(32)28(34)31-16-18-11-12-20-6-1-2-7-21(20)13-18/h1-15,33H,16-17H2,(H3,29,30)(H,31,34)