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

Systemtic Name: 1-(3-methyl-4-pyridin-1-ium-1-yl-cyclohex-3-en-1-yl)ethanone bromide Openeye Name: 1-(3-methyl-4-pyridin-1-ium-1-yl-cyclohex-3-en-1-yl)ethanone bromide CAS Name: 1-[3-methyl-4-(1-pyridin-1-iumyl)-1-cyclohex-3-enyl]ethanone bromide IUPAC Name: 1-(3-methyl-4-pyridin-1-ium-1-ylcyclohex-3-en-1-yl)ethanone bromide Traditional Name: 1-(3-methyl-4-pyridin-1-ium-1-yl-cyclohex-3-en-1-yl)ethanone bromide Formula: C14H18BrNO MolecularWeight: 296.20282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC(C1)C(=O)C)[N+]2=CC=CC=C2.[Br-]

Isomeric SMILES

CC1=C(CCC(C1)C(=O)C)[N+]2=CC=CC=C2.[Br-]

InChI

InChI=1S/C14H18NO.BrH/c1-11-10-13(12(2)16)6-7-14(11)15-8-4-3-5-9-15;/h3-5,8-9,13H,6-7,10H2,1-2H3;1H/q+1;/p-1