3-[(4-cyano-3-propan-2-yl-pyrido[1,2-a]benzimidazol-1-yl)amino]propyl-dimethyl-azanium

Systemtic Name: 3-[(4-cyano-3-propan-2-yl-pyrido[1,2-a]benzimidazol-1-yl)amino]propyl-dimethyl-azanium Openeye Name: 3-[(4-cyano-3-isopropyl-pyrido[1,2-a]benzimidazol-1-yl)amino]propyl-dimethyl-ammonium CAS Name: 3-[(4-cyano-3-propan-2-yl-1-pyrido[1,2-a]benzimidazolyl)amino]propyl-dimethylammonium IUPAC Name: 3-[(4-cyano-3-propan-2-ylpyrido[1,2-a]benzimidazol-1-yl)amino]propyl-dimethylazanium Traditional Name: 3-[(4-cyano-3-isopropyl-pyrido[1,2-a]benzimidazol-1-yl)amino]propyl-dimethyl-ammonium Formula: C20H26N5+ MolecularWeight: 336.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)NCCC[NH+](C)C)C#N

Isomeric SMILES

CC(C)C1=C(C2=NC3=CC=CC=C3N2C(=C1)NCCC[NH+](C)C)C#N

InChI

InChI=1S/C20H25N5/c1-14(2)15-12-19(22-10-7-11-24(3)4)25-18-9-6-5-8-17(18)23-20(25)16(15)13-21/h5-6,8-9,12,14,22H,7,10-11H2,1-4H3/p+1