3-(1-methylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide

Systemtic Name: 3-(1-methylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide Openeye Name: 3-(1-methylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide CAS Name: 3-(1-methyl-2-pyridin-1-iumyl)-1-phenyl-1-propanone iodide IUPAC Name: 3-(1-methylpyridin-1-ium-2-yl)-1-phenylpropan-1-one iodide Traditional Name: 3-(1-methylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide Formula: C15H16INO MolecularWeight: 353.19811

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1CCC(=O)C2=CC=CC=C2.[I-]

Isomeric SMILES

C[N+]1=CC=CC=C1CCC(=O)C2=CC=CC=C2.[I-]

InChI

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