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

Systemtic Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethyl-azanium Openeye Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethyl-ammonium CAS Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethylammonium IUPAC Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethylazanium Traditional Name: 3-[(4-cyano-2-ethyl-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethyl-ammonium Formula: C22H31N5+2 MolecularWeight: 365.51504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N5/c1-5-17-16(4)18(15-23)22-25-19-11-8-9-12-20(19)27(22)21(17)24-13-10-14-26(6-2)7-3/h8-9,11-12H,5-7,10,13-14H2,1-4H3,(H,24,25)/p+2