2-(3-bromophenyl)-3-(2-methylbutyl)-1H-benzimidazol-3-ium

Systemtic Name: 2-(3-bromophenyl)-3-(2-methylbutyl)-1H-benzimidazol-3-ium Openeye Name: 2-(3-bromophenyl)-3-(2-methylbutyl)-1H-benzimidazol-3-ium CAS Name: 2-(3-bromophenyl)-3-(2-methylbutyl)-1H-benzimidazol-3-ium IUPAC Name: 2-(3-bromophenyl)-3-(2-methylbutyl)-1H-benzimidazol-3-ium Traditional Name: 2-(3-bromophenyl)-3-(2-methylbutyl)-1H-benzimidazol-3-ium Formula: C18H20BrN2+ MolecularWeight: 344.2688

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C[N+]1=C(NC2=CC=CC=C21)C3=CC(=CC=C3)Br

Isomeric SMILES

CCC(C)C[N+]1=C(NC2=CC=CC=C21)C3=CC(=CC=C3)Br

InChI

InChI=1S/C18H19BrN2/c1-3-13(2)12-21-17-10-5-4-9-16(17)20-18(21)14-7-6-8-15(19)11-14/h4-11,13H,3,12H2,1-2H3/p+1