1-(4-fluorophenyl)-2-(4-methylpyrimidin-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-fluorophenyl)-2-(4-methylpyrimidin-1-ium-1-yl)ethanone bromide Openeye Name: 1-(4-fluorophenyl)-2-(4-methylpyrimidin-1-ium-1-yl)ethanone bromide CAS Name: 1-(4-fluorophenyl)-2-(4-methyl-1-pyrimidin-1-iumyl)ethanone bromide IUPAC Name: 1-(4-fluorophenyl)-2-(4-methylpyrimidin-1-ium-1-yl)ethanone bromide Traditional Name: 1-(4-fluorophenyl)-2-(4-methylpyrimidin-1-ium-1-yl)ethanone bromide Formula: C13H12BrFN2O MolecularWeight: 311.149583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)F.[Br-]

Isomeric SMILES

CC1=NC=[N+](C=C1)CC(=O)C2=CC=C(C=C2)F.[Br-]

InChI

InChI=1S/C13H12FN2O.BrH/c1-10-6-7-16(9-15-10)8-13(17)11-2-4-12(14)5-3-11;/h2-7,9H,8H2,1H3;1H/q+1;/p-1