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

Systemtic Name: 2-[[4-cyano-3-(trifluoromethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl]amino]ethyl-diethyl-azanium Openeye Name: 2-[[4-cyano-3-(trifluoromethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[4-cyano-3-(trifluoromethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-cyano-3-(trifluoromethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-cyano-3-(trifluoromethyl)-5H-pyrido[1,2-a]benzimidazol-10-ium-1-yl]amino]ethyl-diethyl-ammonium Formula: C19H22F3N5+2 MolecularWeight: 377.40669

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC1=[N+]2C3=CC=CC=C3NC2=C(C(=C1)C(F)(F)F)C#N

Isomeric SMILES

CC[NH+](CC)CCNC1=[N+]2C3=CC=CC=C3NC2=C(C(=C1)C(F)(F)F)C#N

InChI

InChI=1S/C19H20F3N5/c1-3-26(4-2)10-9-24-17-11-14(19(20,21)22)13(12-23)18-25-15-7-5-6-8-16(15)27(17)18/h5-8,11H,3-4,9-10H2,1-2H3,(H,24,25)/p+2