2-bromanyl-1-[1-(hydroxymethyl)-1-pyridin-2-yl-2H-pyridin-1-ium-6-yl]ethanone

Systemtic Name: 2-bromanyl-1-[1-(hydroxymethyl)-1-pyridin-2-yl-2H-pyridin-1-ium-6-yl]ethanone Openeye Name: 2-bromo-1-[1-(hydroxymethyl)-1-(2-pyridyl)-2H-pyridin-1-ium-6-yl]ethanone CAS Name: 2-bromo-1-[1-(hydroxymethyl)-1-(2-pyridinyl)-2H-pyridin-1-ium-6-yl]ethanone IUPAC Name: 2-bromo-1-[1-(hydroxymethyl)-1-pyridin-2-yl-2H-pyridin-1-ium-6-yl]ethanone Traditional Name: 2-bromo-1-[1-methylol-1-(2-pyridyl)-2H-pyridin-1-ium-6-yl]ethanone Formula: C13H14BrN2O2+ MolecularWeight: 310.16646

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C([N+]1(CO)C2=CC=CC=N2)C(=O)CBr

Isomeric SMILES

C1C=CC=C([N+]1(CO)C2=CC=CC=N2)C(=O)CBr

InChI

InChI=1S/C13H14BrN2O2/c14-9-12(18)11-5-2-4-8-16(11,10-17)13-6-1-3-7-15-13/h1-7,17H,8-10H2/q+1