2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide

Systemtic Name: 2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide CAS Name: 2-[3-(hydroxymethyl)-1-pyridin-1-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenylethanone bromide Traditional Name: 2-(3-methylolpyridin-1-ium-1-yl)-1-phenyl-ethanone bromide Formula: C14H14BrNO2 MolecularWeight: 308.17046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)CO.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=CC(=C2)CO.[Br-]

InChI

InChI=1S/C14H14NO2.BrH/c16-11-12-5-4-8-15(9-12)10-14(17)13-6-2-1-3-7-13;/h1-9,16H,10-11H2;1H/q+1;/p-1