2-(1-octylsulfanylnonyl)-2-(sulfanylmethyl)propane-1,3-diol

Systemtic Name: 2-(1-octylsulfanylnonyl)-2-(sulfanylmethyl)propane-1,3-diol Openeye Name: 2-(1-octylsulfanylnonyl)-2-(sulfanylmethyl)propane-1,3-diol CAS Name: 2-(mercaptomethyl)-2-[1-(octylthio)nonyl]propane-1,3-diol IUPAC Name: 2-(1-octylsulfanylnonyl)-2-(sulfanylmethyl)propane-1,3-diol Traditional Name: 2-(mercaptomethyl)-2-[1-(octylthio)nonyl]propane-1,3-diol Formula: C21H44O2S2 MolecularWeight: 392.70286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(CO)(CO)CS)SCCCCCCCC

Isomeric SMILES

CCCCCCCCC(C(CO)(CO)CS)SCCCCCCCC

InChI

InChI=1S/C21H44O2S2/c1-3-5-7-9-11-13-15-20(21(17-22,18-23)19-24)25-16-14-12-10-8-6-4-2/h20,22-24H,3-19H2,1-2H3