2-(3-methylpyridin-1-ium-1-yl)-1-phenyl-propan-1-one bromide

Systemtic Name: 2-(3-methylpyridin-1-ium-1-yl)-1-phenyl-propan-1-one bromide Openeye Name: 2-(3-methylpyridin-1-ium-1-yl)-1-phenyl-propan-1-one bromide CAS Name: 2-(3-methyl-1-pyridin-1-iumyl)-1-phenyl-1-propanone bromide IUPAC Name: 2-(3-methylpyridin-1-ium-1-yl)-1-phenylpropan-1-one bromide Traditional Name: 2-(3-methylpyridin-1-ium-1-yl)-1-phenyl-propan-1-one bromide Formula: C15H16BrNO MolecularWeight: 306.19764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16NO.BrH/c1-12-7-6-10-16(11-12)13(2)15(17)14-8-4-3-5-9-14;/h3-11,13H,1-2H3;1H/q+1;/p-1