4-(3-hexadecylsulfanyl-2-methoxy-propyl)-4-methyl-morpholin-4-ium iodide

Systemtic Name: 4-(3-hexadecylsulfanyl-2-methoxy-propyl)-4-methyl-morpholin-4-ium iodide Openeye Name: 4-(3-hexadecylsulfanyl-2-methoxy-propyl)-4-methyl-morpholin-4-ium iodide CAS Name: 4-[3-(hexadecylthio)-2-methoxypropyl]-4-methylmorpholin-4-ium iodide IUPAC Name: 4-(3-hexadecylsulfanyl-2-methoxypropyl)-4-methylmorpholin-4-ium iodide Traditional Name: 4-[3-(cetylthio)-2-methoxy-propyl]-4-methyl-morpholin-4-ium iodide Formula: C25H52INO2S MolecularWeight: 557.65535

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H52NO2S.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-29-24-25(27-3)23-26(2)18-20-28-21-19-26;/h25H,4-24H2,1-3H3;1H/q+1;/p-1