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

Systemtic Name: 3-[(4-cyano-3-methyl-2-prop-2-enyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethyl-azanium Openeye Name: 3-[(2-allyl-4-cyano-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethyl-ammonium CAS Name: 3-[(4-cyano-3-methyl-2-prop-2-enyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethylammonium IUPAC Name: 3-[(4-cyano-3-methyl-2-prop-2-enyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethylazanium Traditional Name: 3-[(2-allyl-4-cyano-3-methyl-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl)amino]propyl-diethyl-ammonium Formula: C23H31N5+2 MolecularWeight: 377.52574

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC1=C(C(=C(C2=[N+]1C3=CC=CC=C3N2)C#N)C)CC=C

Isomeric SMILES

CC[NH+](CC)CCCNC1=C(C(=C(C2=[N+]1C3=CC=CC=C3N2)C#N)C)CC=C

InChI

InChI=1S/C23H29N5/c1-5-11-18-17(4)19(16-24)23-26-20-12-8-9-13-21(20)28(23)22(18)25-14-10-15-27(6-2)7-3/h5,8-9,12-13H,1,6-7,10-11,14-15H2,2-4H3,(H,25,26)/p+2