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1-[1-(3-methylbut-2-enyl)pyridin-1-ium-3-yl]ethanone bromide

1-[1-(3-methylbut-2-enyl)pyridin-1-ium-3-yl]ethanone bromide

Systemtic Name:1-[1-(3-methylbut-2-enyl)pyridin-1-ium-3-yl]ethanone bromide
Openeye Name:1-[1-(3-methylbut-2-enyl)pyridin-1-ium-3-yl]ethanone bromide
CAS Name:1-[1-(3-methylbut-2-enyl)-3-pyridin-1-iumyl]ethanone bromide
IUPAC Name:1-[1-(3-methylbut-2-enyl)pyridin-1-ium-3-yl]ethanone bromide
Traditional Name:1-[1-(3-methylbut-2-enyl)pyridin-1-ium-3-yl]ethanone bromide
Formula: C12H16BrNO
MolecularWeight: 270.16554
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H16NO.BrH/c1-10(2)6-8-13-7-4-5-12(9-13)11(3)14;/h4-7,9H,8H2,1-3H3;1H/q+1;/p-1


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