1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide

Systemtic Name: 1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide Openeye Name: 1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide CAS Name: 1-(1-ethyl-3-pyridin-1-iumyl)ethanone bromide IUPAC Name: 1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide Traditional Name: 1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide Formula: C9H12BrNO MolecularWeight: 230.10168

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CC=CC(=C1)C(=O)C.[Br-]

Isomeric SMILES

CC[N+]1=CC=CC(=C1)C(=O)C.[Br-]

InChI

InChI=1S/C9H12NO.BrH/c1-3-10-6-4-5-9(7-10)8(2)11;/h4-7H,3H2,1-2H3;1H/q+1;/p-1