S-[2-(4-methylmorpholin-4-ium-4-yl)ethyl] hexadecanethioate iodide

Systemtic Name: S-[2-(4-methylmorpholin-4-ium-4-yl)ethyl] hexadecanethioate iodide Openeye Name: S-[2-(4-methylmorpholin-4-ium-4-yl)ethyl] hexadecanethioate iodide CAS Name: hexadecanethioic acid S-[2-(4-methyl-4-morpholin-4-iumyl)ethyl] ester iodide IUPAC Name: S-[2-(4-methylmorpholin-4-ium-4-yl)ethyl] hexadecanethioate iodide Traditional Name: hexadecanethioic acid S-[2-(4-methylmorpholin-4-ium-4-yl)ethyl] ester iodide Formula: C23H46INO2S MolecularWeight: 527.58631

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)SCC[N+]1(CCOCC1)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)SCC[N+]1(CCOCC1)C.[I-]

InChI

InChI=1S/C23H46NO2S.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23(25)27-22-19-24(2)17-20-26-21-18-24;/h3-22H2,1-2H3;1H/q+1;/p-1