2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1-(4-fluorophenyl)ethanone chloride

Systemtic Name: 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1-(4-fluorophenyl)ethanone chloride Openeye Name: 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1-(4-fluorophenyl)ethanone chloride CAS Name: 2-(2,3-dimethyl-1-benzimidazol-3-iumyl)-1-(4-fluorophenyl)ethanone chloride IUPAC Name: 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1-(4-fluorophenyl)ethanone chloride Traditional Name: 2-(2,3-dimethylbenzimidazol-3-ium-1-yl)-1-(4-fluorophenyl)ethanone chloride Formula: C17H16ClFN2O MolecularWeight: 318.773143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2N1CC(=O)C3=CC=C(C=C3)F)C.[Cl-]

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2N1CC(=O)C3=CC=C(C=C3)F)C.[Cl-]

InChI

InChI=1S/C17H16FN2O.ClH/c1-12-19(2)15-5-3-4-6-16(15)20(12)11-17(21)13-7-9-14(18)10-8-13;/h3-10H,11H2,1-2H3;1H/q+1;/p-1