O-[3-octadecanethioyloxy-2,2-bis(octadecanethioyloxymethyl)propyl] octadecanethioate

Systemtic Name: O-[3-octadecanethioyloxy-2,2-bis(octadecanethioyloxymethyl)propyl] octadecanethioate Openeye Name: O-[3-octadecanethioyloxy-2,2-bis(octadecanethioyloxymethyl)propyl] octadecanethioate CAS Name: octadecanethioic acid O-[3-(1-sulfanylideneoctadecoxy)-2,2-bis(1-sulfanylideneoctadecoxymethyl)propyl] ester IUPAC Name: O-[3-octadecanethioyloxy-2,2-bis(octadecanethioyloxymethyl)propyl] octadecanethioate Traditional Name: octadecanethioic acid O-[3-octadecanethioyloxy-2,2-bis(octadecanethioyloxymethyl)propyl] ester Formula: C77H148O4S4 MolecularWeight: 1266.25662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=S)OCC(COC(=S)CCCCCCCCCCCCCCCCC)(COC(=S)CCCCCCCCCCCCCCCCC)COC(=S)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=S)OCC(COC(=S)CCCCCCCCCCCCCCCCC)(COC(=S)CCCCCCCCCCCCCCCCC)COC(=S)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C77H148O4S4/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-65-73(82)78-69-77(70-79-74(83)66-62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2,71-80-75(84)67-63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)72-81-76(85)68-64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h5-72H2,1-4H3