3-(benzimidazol-1-yl)propyl-[[4-[2-cyanoethyl(ethyl)amino]-2-methyl-phenyl]methyl]azanium

Systemtic Name: 3-(benzimidazol-1-yl)propyl-[[4-[2-cyanoethyl(ethyl)amino]-2-methyl-phenyl]methyl]azanium Openeye Name: 3-(benzimidazol-1-yl)propyl-[[4-[2-cyanoethyl(ethyl)amino]-2-methyl-phenyl]methyl]ammonium CAS Name: 3-(1-benzimidazolyl)propyl-[[4-[2-cyanoethyl(ethyl)amino]-2-methylphenyl]methyl]ammonium IUPAC Name: 3-(benzimidazol-1-yl)propyl-[[4-[2-cyanoethyl(ethyl)amino]-2-methylphenyl]methyl]azanium Traditional Name: 3-(benzimidazol-1-yl)propyl-[4-[2-cyanoethyl(ethyl)amino]-2-methyl-benzyl]ammonium Formula: C23H30N5+ MolecularWeight: 376.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCC#N)C1=CC(=C(C=C1)C[NH2+]CCCN2C=NC3=CC=CC=C32)C

Isomeric SMILES

CCN(CCC#N)C1=CC(=C(C=C1)C[NH2+]CCCN2C=NC3=CC=CC=C32)C

InChI

InChI=1S/C23H29N5/c1-3-27(14-6-12-24)21-11-10-20(19(2)16-21)17-25-13-7-15-28-18-26-22-8-4-5-9-23(22)28/h4-5,8-11,16,18,25H,3,6-7,13-15,17H2,1-2H3/p+1