2-(3-methylpyridin-1-ium-1-yl)-1-(4-phenylphenyl)propan-1-one bromide

Systemtic Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-phenylphenyl)propan-1-one bromide Openeye Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-phenylphenyl)propan-1-one bromide CAS Name: 2-(3-methyl-1-pyridin-1-iumyl)-1-(4-phenylphenyl)-1-propanone bromide IUPAC Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-phenylphenyl)propan-1-one bromide Traditional Name: 2-(3-methylpyridin-1-ium-1-yl)-1-(4-phenylphenyl)propan-1-one bromide Formula: C21H20BrNO MolecularWeight: 382.2936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)C(C)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=C[N+](=CC=C1)C(C)C(=O)C2=CC=C(C=C2)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C21H20NO.BrH/c1-16-7-6-14-22(15-16)17(2)21(23)20-12-10-19(11-13-20)18-8-4-3-5-9-18;/h3-15,17H,1-2H3;1H/q+1;/p-1