2-(4-pentylpyridin-1-ium-1-yl)-1-thiophen-2-yl-ethanone iodide

Systemtic Name: 2-(4-pentylpyridin-1-ium-1-yl)-1-thiophen-2-yl-ethanone iodide Openeye Name: 2-(4-pentylpyridin-1-ium-1-yl)-1-(2-thienyl)ethanone iodide CAS Name: 2-(4-pentyl-1-pyridin-1-iumyl)-1-thiophen-2-ylethanone iodide IUPAC Name: 2-(4-pentylpyridin-1-ium-1-yl)-1-thiophen-2-ylethanone iodide Traditional Name: 2-(4-amylpyridin-1-ium-1-yl)-1-(2-thienyl)ethanone iodide Formula: C16H20INOS MolecularWeight: 401.30557

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=[N+](C=C1)CC(=O)C2=CC=CS2.[I-]

Isomeric SMILES

CCCCCC1=CC=[N+](C=C1)CC(=O)C2=CC=CS2.[I-]

InChI

InChI=1S/C16H20NOS.HI/c1-2-3-4-6-14-8-10-17(11-9-14)13-15(18)16-7-5-12-19-16;/h5,7-12H,2-4,6,13H2,1H3;1H/q+1;/p-1