1-(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)propan-2-one bromide

Systemtic Name: 1-(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)propan-2-one bromide Openeye Name: 1-(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)propan-2-one bromide CAS Name: 1-(3-methyl-2-phenyl-1-benzimidazol-3-iumyl)-2-propanone bromide IUPAC Name: 1-(3-methyl-2-phenylbenzimidazol-3-ium-1-yl)propan-2-one bromide Traditional Name: 1-(3-methyl-2-phenyl-benzimidazol-3-ium-1-yl)acetone bromide Formula: C17H17BrN2O MolecularWeight: 345.23368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C2=CC=CC=C2[N+](=C1C3=CC=CC=C3)C.[Br-]

Isomeric SMILES

CC(=O)CN1C2=CC=CC=C2[N+](=C1C3=CC=CC=C3)C.[Br-]

InChI

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