2-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]ethyl-diethyl-azanium Openeye Name: 2-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]ethyl-diethyl-ammonium CAS Name: 2-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]ethyl-diethylammonium IUPAC Name: 2-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]ethyl-diethylazanium Traditional Name: 2-[2-(4-bromophenyl)-4H-imidazo[1,2-a]benzimidazol-9-ium-3-yl]ethyl-diethyl-ammonium Formula: C21H25BrN4+2 MolecularWeight: 413.354

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=C[N+]2=C1NC3=CC=CC=C32)C4=CC=C(C=C4)Br

Isomeric SMILES

CC[NH+](CC)CCN1C(=C[N+]2=C1NC3=CC=CC=C32)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H23BrN4/c1-3-24(4-2)13-14-25-20(16-9-11-17(22)12-10-16)15-26-19-8-6-5-7-18(19)23-21(25)26/h5-12,15H,3-4,13-14H2,1-2H3/p+2