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

Systemtic Name: 2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone Openeye Name: 2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone CAS Name: 2-[3-(hydroxymethyl)-1-pyridin-1-iumyl]-1-phenylethanone IUPAC Name: 2-[3-(hydroxymethyl)pyridin-1-ium-1-yl]-1-phenylethanone Traditional Name: 2-(3-methylolpyridin-1-ium-1-yl)-1-phenyl-ethanone Formula: C14H14NO2+ MolecularWeight: 228.26646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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