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1-[3-methyl-2-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanone bromide

1-[3-methyl-2-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanone bromide

Systemtic Name:1-[3-methyl-2-(phenylmethyl)benzimidazol-3-ium-1-yl]ethanone bromide
Openeye Name:1-(2-benzyl-3-methyl-benzimidazol-3-ium-1-yl)ethanone bromide
CAS Name:1-[3-methyl-2-(phenylmethyl)-1-benzimidazol-3-iumyl]ethanone bromide
IUPAC Name:1-(2-benzyl-3-methylbenzimidazol-3-ium-1-yl)ethanone bromide
Traditional Name:1-(2-benzyl-3-methyl-benzimidazol-3-ium-1-yl)ethanone bromide
Formula: C17H17BrN2O
MolecularWeight: 345.23368
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C2=CC=CC=C2[N+](=C1CC3=CC=CC=C3)C.[Br-]


Isomeric SMILES

CC(=O)N1C2=CC=CC=C2[N+](=C1CC3=CC=CC=C3)C.[Br-]


InChI

InChI=1S/C17H17N2O.BrH/c1-13(20)19-16-11-7-6-10-15(16)18(2)17(19)12-14-8-4-3-5-9-14;/h3-11H,12H2,1-2H3;1H/q+1;/p-1


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