1-[2-(phenylmethyl)pyridin-1-ium-1-yl]propan-2-one iodide

Systemtic Name: 1-[2-(phenylmethyl)pyridin-1-ium-1-yl]propan-2-one iodide Openeye Name: 1-(2-benzylpyridin-1-ium-1-yl)propan-2-one iodide CAS Name: 1-[2-(phenylmethyl)-1-pyridin-1-iumyl]-2-propanone iodide IUPAC Name: 1-(2-benzylpyridin-1-ium-1-yl)propan-2-one iodide Traditional Name: 1-(2-benzylpyridin-1-ium-1-yl)acetone iodide Formula: C15H16INO MolecularWeight: 353.19811

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C[N+]1=CC=CC=C1CC2=CC=CC=C2.[I-]

Isomeric SMILES

CC(=O)C[N+]1=CC=CC=C1CC2=CC=CC=C2.[I-]

InChI

InChI=1S/C15H16NO.HI/c1-13(17)12-16-10-6-5-9-15(16)11-14-7-3-2-4-8-14;/h2-10H,11-12H2,1H3;1H/q+1;/p-1