2-[2-(4-bromophenyl)-3H-imidazo[1,2-a]benzimidazol-4-ium-4-yl]-N,N-diethyl-ethanamine

Systemtic Name: 2-[2-(4-bromophenyl)-3H-imidazo[1,2-a]benzimidazol-4-ium-4-yl]-N,N-diethyl-ethanamine Openeye Name: 2-[2-(4-bromophenyl)-3H-imidazo[1,2-a]benzimidazol-4-ium-4-yl]-N,N-diethyl-ethanamine CAS Name: 2-[2-(4-bromophenyl)-3H-imidazo[1,2-a]benzimidazol-4-ium-4-yl]-N,N-diethylethanamine IUPAC Name: 2-[2-(4-bromophenyl)-3H-imidazo[1,2-a]benzimidazol-4-ium-4-yl]-N,N-diethylethanamine Traditional Name: 2-[2-(4-bromophenyl)-3H-imidazo[1,2-a]benzimidazol-4-ium-4-yl]ethyl-diethyl-amine Formula: C21H24BrN4+ MolecularWeight: 412.34606

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC[N+]1=C2NC(=CN2C3=CC=CC=C31)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN(CC)CC[N+]1=C2NC(=CN2C3=CC=CC=C31)C4=CC=C(C=C4)Br

InChI

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