[3-(2-sulfanylpentadecanoyloxy)-2,2-bis(2-sulfanylpentadecanoyloxymethyl)propyl] 2-sulfanylpentadecanoate

Systemtic Name: [3-(2-sulfanylpentadecanoyloxy)-2,2-bis(2-sulfanylpentadecanoyloxymethyl)propyl] 2-sulfanylpentadecanoate Openeye Name: [3-(2-sulfanylpentadecanoyloxy)-2,2-bis(2-sulfanylpentadecanoyloxymethyl)propyl] 2-sulfanylpentadecanoate CAS Name: 2-mercaptopentadecanoic acid [3-(2-mercapto-1-oxopentadecoxy)-2,2-bis[(2-mercapto-1-oxopentadecoxy)methyl]propyl] ester IUPAC Name: [3-(2-sulfanylpentadecanoyloxy)-2,2-bis(2-sulfanylpentadecanoyloxymethyl)propyl] 2-sulfanylpentadecanoate Traditional Name: 2-mercaptopentadecanoic acid [3-(2-mercaptopentadecanoyloxy)-2,2-bis(2-mercaptopentadecanoyloxymethyl)propyl] ester Formula: C65H124O8S4 MolecularWeight: 1161.93526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(=O)OCC(COC(=O)C(CCCCCCCCCCCCC)S)(COC(=O)C(CCCCCCCCCCCCC)S)COC(=O)C(CCCCCCCCCCCCC)S)S

Isomeric SMILES

CCCCCCCCCCCCCC(C(=O)OCC(COC(=O)C(CCCCCCCCCCCCC)S)(COC(=O)C(CCCCCCCCCCCCC)S)COC(=O)C(CCCCCCCCCCCCC)S)S

InChI

InChI=1S/C65H124O8S4/c1-5-9-13-17-21-25-29-33-37-41-45-49-57(74)61(66)70-53-65(54-71-62(67)58(75)50-46-42-38-34-30-26-22-18-14-10-6-2,55-72-63(68)59(76)51-47-43-39-35-31-27-23-19-15-11-7-3)56-73-64(69)60(77)52-48-44-40-36-32-28-24-20-16-12-8-4/h57-60,74-77H,5-56H2,1-4H3