12-hexadecylsulfanyl-12-oxidanylidene-dodecanethioic S-acid

Systemtic Name: 12-hexadecylsulfanyl-12-oxidanylidene-dodecanethioic S-acid Openeye Name: 12-hexadecylsulfanyl-12-oxo-dodecanethioic S-acid CAS Name: 12-(hexadecylthio)-12-oxododecanethioic S-acid IUPAC Name: 12-hexadecylsulfanyl-12-oxododecanethioic S-acid Traditional Name: 12-(cetylthio)-12-keto-thiolauric acid Formula: C28H54O2S2 MolecularWeight: 486.85716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSC(=O)CCCCCCCCCCC(=O)S

Isomeric SMILES

CCCCCCCCCCCCCCCCSC(=O)CCCCCCCCCCC(=O)S

InChI

InChI=1S/C28H54O2S2/c1-2-3-4-5-6-7-8-9-10-11-14-17-20-23-26-32-28(30)25-22-19-16-13-12-15-18-21-24-27(29)31/h2-26H2,1H3,(H,29,31)