2-hexadecylsulfanyl-2-oxidanyl-ethanoate

Systemtic Name: 2-hexadecylsulfanyl-2-oxidanyl-ethanoate Openeye Name: 2-hexadecylsulfanyl-2-hydroxy-acetate CAS Name: 2-(hexadecylthio)-2-hydroxyacetate IUPAC Name: 2-hexadecylsulfanyl-2-hydroxyacetate Traditional Name: 2-(cetylthio)-2-hydroxy-acetate Formula: C18H35O3S- MolecularWeight: 331.5337

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC(C(=O)[O-])O

Isomeric SMILES

CCCCCCCCCCCCCCCCSC(C(=O)[O-])O

InChI

InChI=1S/C18H36O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-18(21)17(19)20/h18,21H,2-16H2,1H3,(H,19,20)/p-1