4-(2-hexadecylsulfanylethyl)-4-methyl-morpholin-4-ium iodide

Systemtic Name: 4-(2-hexadecylsulfanylethyl)-4-methyl-morpholin-4-ium iodide Openeye Name: 4-(2-hexadecylsulfanylethyl)-4-methyl-morpholin-4-ium iodide CAS Name: 4-[2-(hexadecylthio)ethyl]-4-methylmorpholin-4-ium iodide IUPAC Name: 4-(2-hexadecylsulfanylethyl)-4-methylmorpholin-4-ium iodide Traditional Name: 4-[2-(cetylthio)ethyl]-4-methyl-morpholin-4-ium iodide Formula: C23H48INOS MolecularWeight: 513.60279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC[N+]1(CCOCC1)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC[N+]1(CCOCC1)C.[I-]

InChI

InChI=1S/C23H48NOS.HI/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-26-23-19-24(2)17-20-25-21-18-24;/h3-23H2,1-2H3;1H/q+1;/p-1