1-pyridin-1-ium-1-ylpentan-2-one bromide

Systemtic Name: 1-pyridin-1-ium-1-ylpentan-2-one bromide Openeye Name: 1-pyridin-1-ium-1-ylpentan-2-one bromide CAS Name: 1-(1-pyridin-1-iumyl)-2-pentanone bromide IUPAC Name: 1-pyridin-1-ium-1-ylpentan-2-one bromide Traditional Name: 1-pyridin-1-ium-1-ylpentan-2-one bromide Formula: C10H14BrNO MolecularWeight: 244.12826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14NO.BrH/c1-2-6-10(12)9-11-7-4-3-5-8-11;/h3-5,7-8H,2,6,9H2,1H3;1H/q+1;/p-1