1-(4-pyridin-1-ium-1-ylcyclohex-3-en-1-yl)ethanone bromide

Systemtic Name: 1-(4-pyridin-1-ium-1-ylcyclohex-3-en-1-yl)ethanone bromide Openeye Name: 1-(4-pyridin-1-ium-1-ylcyclohex-3-en-1-yl)ethanone bromide CAS Name: 1-[4-(1-pyridin-1-iumyl)-1-cyclohex-3-enyl]ethanone bromide IUPAC Name: 1-(4-pyridin-1-ium-1-ylcyclohex-3-en-1-yl)ethanone bromide Traditional Name: 1-(4-pyridin-1-ium-1-ylcyclohex-3-en-1-yl)ethanone bromide Formula: C13H16BrNO MolecularWeight: 282.17624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CCC(=CC1)[N+]2=CC=CC=C2.[Br-]

Isomeric SMILES

CC(=O)C1CCC(=CC1)[N+]2=CC=CC=C2.[Br-]

InChI

InChI=1S/C13H16NO.BrH/c1-11(15)12-5-7-13(8-6-12)14-9-3-2-4-10-14;/h2-4,7,9-10,12H,5-6,8H2,1H3;1H/q+1;/p-1