[4-[[[1-[(3-carbamimidoylphenyl)methyl]-5-methyl-indol-2-yl]carbonylamino]methyl]phenyl]-trimethyl-azanium

Systemtic Name: [4-[[[1-[(3-carbamimidoylphenyl)methyl]-5-methyl-indol-2-yl]carbonylamino]methyl]phenyl]-trimethyl-azanium Openeye Name: [4-[[[1-[(3-carbamimidoylphenyl)methyl]-5-methyl-indole-2-carbonyl]amino]methyl]phenyl]-trimethyl-ammonium CAS Name: [4-[[[[1-[(3-carbamimidoylphenyl)methyl]-5-methyl-2-indolyl]-oxomethyl]amino]methyl]phenyl]-trimethylammonium IUPAC Name: [4-[[[1-[(3-carbamimidoylphenyl)methyl]-5-methylindole-2-carbonyl]amino]methyl]phenyl]-trimethylazanium Traditional Name: [4-[[[1-(3-amidinobenzyl)-5-methyl-indole-2-carbonyl]amino]methyl]phenyl]-trimethyl-ammonium Formula: C28H32N5O+ MolecularWeight: 454.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NCC3=CC=C(C=C3)[N+](C)(C)C)CC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2)C(=O)NCC3=CC=C(C=C3)[N+](C)(C)C)CC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C28H31N5O/c1-19-8-13-25-23(14-19)16-26(32(25)18-21-6-5-7-22(15-21)27(29)30)28(34)31-17-20-9-11-24(12-10-20)33(2,3)4/h5-16H,17-18H2,1-4H3,(H3-,29,30,31,34)/p+1