1-[3,5-bis(bromanyl)phenyl]-2-(2-methylpyridin-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-[3,5-bis(bromanyl)phenyl]-2-(2-methylpyridin-1-ium-1-yl)ethanone bromide Openeye Name: 1-(3,5-dibromophenyl)-2-(2-methylpyridin-1-ium-1-yl)ethanone bromide CAS Name: 1-(3,5-dibromophenyl)-2-(2-methyl-1-pyridin-1-iumyl)ethanone bromide IUPAC Name: 1-(3,5-dibromophenyl)-2-(2-methylpyridin-1-ium-1-yl)ethanone bromide Traditional Name: 1-(3,5-dibromophenyl)-2-(2-methylpyridin-1-ium-1-yl)ethanone bromide Formula: C14H12Br3NO MolecularWeight: 449.96318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1CC(=O)C2=CC(=CC(=C2)Br)Br.[Br-]

Isomeric SMILES

CC1=CC=CC=[N+]1CC(=O)C2=CC(=CC(=C2)Br)Br.[Br-]

InChI

InChI=1S/C14H12Br2NO.BrH/c1-10-4-2-3-5-17(10)9-14(18)11-6-12(15)8-13(16)7-11;/h2-8H,9H2,1H3;1H/q+1;/p-1