[4-[[[1-[(3-carbamimidoylphenyl)methyl]-4-oxidanyl-indol-2-yl]carbonylamino]methyl]phenyl]-trimethyl-azanium

Systemtic Name: [4-[[[1-[(3-carbamimidoylphenyl)methyl]-4-oxidanyl-indol-2-yl]carbonylamino]methyl]phenyl]-trimethyl-azanium Openeye Name: [4-[[[1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-indole-2-carbonyl]amino]methyl]phenyl]-trimethyl-ammonium CAS Name: [4-[[[[1-[(3-carbamimidoylphenyl)methyl]-4-hydroxy-2-indolyl]-oxomethyl]amino]methyl]phenyl]-trimethylammonium IUPAC Name: [4-[[[1-[(3-carbamimidoylphenyl)methyl]-4-hydroxyindole-2-carbonyl]amino]methyl]phenyl]-trimethylazanium Traditional Name: [4-[[[1-(3-amidinobenzyl)-4-hydroxy-indole-2-carbonyl]amino]methyl]phenyl]-trimethyl-ammonium Formula: C27H30N5O2+ MolecularWeight: 456.5594

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC=C3O

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)CNC(=O)C2=CC3=C(N2CC4=CC=CC(=C4)C(=N)N)C=CC=C3O

InChI

InChI=1S/C27H29N5O2/c1-32(2,3)21-12-10-18(11-13-21)16-30-27(34)24-15-22-23(8-5-9-25(22)33)31(24)17-19-6-4-7-20(14-19)26(28)29/h4-15H,16-17H2,1-3H3,(H4-,28,29,30,33,34)/p+1