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

Systemtic Name: 3-(1-ethylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide Openeye Name: 3-(1-ethylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide CAS Name: 3-(1-ethyl-2-pyridin-1-iumyl)-1-phenyl-1-propanone iodide IUPAC Name: 3-(1-ethylpyridin-1-ium-2-yl)-1-phenylpropan-1-one iodide Traditional Name: 3-(1-ethylpyridin-1-ium-2-yl)-1-phenyl-propan-1-one iodide Formula: C16H18INO MolecularWeight: 367.22469

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18NO.HI/c1-2-17-13-7-6-10-15(17)11-12-16(18)14-8-4-3-5-9-14;/h3-10,13H,2,11-12H2,1H3;1H/q+1;/p-1