2-hexadecylsulfanyl-2-oxidanyl-tetradecanoic acid

Systemtic Name: 2-hexadecylsulfanyl-2-oxidanyl-tetradecanoic acid Openeye Name: 2-hexadecylsulfanyl-2-hydroxy-tetradecanoic acid CAS Name: 2-(hexadecylthio)-2-hydroxytetradecanoic acid IUPAC Name: 2-hexadecylsulfanyl-2-hydroxytetradecanoic acid Traditional Name: 2-(cetylthio)-2-hydroxy-myristic acid Formula: C30H60O3S MolecularWeight: 500.8606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC(CCCCCCCCCCCC)(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCSC(CCCCCCCCCCCC)(C(=O)O)O

InChI

InChI=1S/C30H60O3S/c1-3-5-7-9-11-13-15-16-17-18-20-22-24-26-28-34-30(33,29(31)32)27-25-23-21-19-14-12-10-8-6-4-2/h33H,3-28H2,1-2H3,(H,31,32)