3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-dimethylammonium IUPAC Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-dimethyl-ammonium Formula: C20H27N5+2 MolecularWeight: 337.46188

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCCC[NH+](C)C

Isomeric SMILES

CCC1=C([N+]2=C(C(=C1C)C#N)NC3=CC=CC=C32)NCCC[NH+](C)C

InChI

InChI=1S/C20H25N5/c1-5-15-14(2)16(13-21)20-23-17-9-6-7-10-18(17)25(20)19(15)22-11-8-12-24(3)4/h6-7,9-10H,5,8,11-12H2,1-4H3,(H,22,23)/p+2