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

Systemtic Name: 1-[(3-carbamimidoylphenyl)methyl]-N-[(naphthalen-2-ylcarbonylamino)methyl]-4-oxidanyl-indole-2-carboxamide Openeye Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[(naphthalene-2-carbonylamino)methyl]indole-2-carboxamide CAS Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[[[2-naphthalenyl(oxo)methyl]amino]methyl]-2-indolecarboxamide IUPAC Name: 1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-N-[(naphthalene-2-carbonylamino)methyl]indole-2-carboxamide Traditional Name: 1-(3-amidinobenzyl)-4-hydroxy-N-[(2-naphthoylamino)methyl]indole-2-carboxamide Formula: C29H25N5O3 MolecularWeight: 491.5405

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H25N5O3/c30-27(31)21-8-3-5-18(13-21)16-34-24-9-4-10-26(35)23(24)15-25(34)29(37)33-17-32-28(36)22-12-11-19-6-1-2-7-20(19)14-22/h1-15,35H,16-17H2,(H3,30,31)(H,32,36)(H,33,37)