1-pyridin-1-ium-1-ylpropan-2-one bromide

Systemtic Name: 1-pyridin-1-ium-1-ylpropan-2-one bromide Openeye Name: 1-pyridin-1-ium-1-ylpropan-2-one bromide CAS Name: 1-(1-pyridin-1-iumyl)-2-propanone bromide IUPAC Name: 1-pyridin-1-ium-1-ylpropan-2-one bromide Traditional Name: 1-pyridin-1-ium-1-ylacetone bromide Formula: C8H10BrNO MolecularWeight: 216.0751

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10NO.BrH/c1-8(10)7-9-5-3-2-4-6-9;/h2-6H,7H2,1H3;1H/q+1;/p-1