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

Systemtic Name: 2-bromanyl-1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide Openeye Name: 2-bromo-1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide CAS Name: 2-bromo-1-(1-ethyl-3-pyridin-1-iumyl)ethanone bromide IUPAC Name: 2-bromo-1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide Traditional Name: 2-bromo-1-(1-ethylpyridin-1-ium-3-yl)ethanone bromide Formula: C9H11Br2NO MolecularWeight: 308.99774

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11BrNO.BrH/c1-2-11-5-3-4-8(7-11)9(12)6-10;/h3-5,7H,2,6H2,1H3;1H/q+1;/p-1