2-(2-bromanyl-3-methyl-benzimidazol-3-ium-1-yl)-1-(4-ethylphenyl)ethanone bromide

Systemtic Name: 2-(2-bromanyl-3-methyl-benzimidazol-3-ium-1-yl)-1-(4-ethylphenyl)ethanone bromide Openeye Name: 2-(2-bromo-3-methyl-benzimidazol-3-ium-1-yl)-1-(4-ethylphenyl)ethanone bromide CAS Name: 2-(2-bromo-3-methyl-1-benzimidazol-3-iumyl)-1-(4-ethylphenyl)ethanone bromide IUPAC Name: 2-(2-bromo-3-methylbenzimidazol-3-ium-1-yl)-1-(4-ethylphenyl)ethanone bromide Traditional Name: 2-(2-bromo-3-methyl-benzimidazol-3-ium-1-yl)-1-(4-ethylphenyl)ethanone bromide Formula: C18H18Br2N2O MolecularWeight: 438.15632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3[N+](=C2Br)C.[Br-]

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3[N+](=C2Br)C.[Br-]

InChI

InChI=1S/C18H18BrN2O.BrH/c1-3-13-8-10-14(11-9-13)17(22)12-21-16-7-5-4-6-15(16)20(2)18(21)19;/h4-11H,3,12H2,1-2H3;1H/q+1;/p-1