[2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methyl-phenyl] 3-tetradecylsulfanylpropanoate

Systemtic Name: [2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methyl-phenyl] 3-tetradecylsulfanylpropanoate Openeye Name: [2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methyl-phenyl] 3-tetradecylsulfanylpropanoate CAS Name: 3-(tetradecylthio)propanoic acid [2-tert-butyl-4-[[5-tert-butyl-2-methyl-4-[1-oxo-3-(tetradecylthio)propoxy]phenyl]thio]-5-methylphenyl] ester IUPAC Name: [2-tert-butyl-4-[5-tert-butyl-2-methyl-4-(3-tetradecylsulfanylpropanoyloxy)phenyl]sulfanyl-5-methylphenyl] 3-tetradecylsulfanylpropanoate Traditional Name: 3-(myristylthio)propionic acid [2-tert-butyl-4-[[5-tert-butyl-2-methyl-4-[3-(myristylthio)propanoyloxy]phenyl]thio]-5-methyl-phenyl] ester Formula: C56H94O4S3 MolecularWeight: 927.53816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCSCCC(=O)OC1=C(C=C(C(=C1)C)SC2=CC(=C(C=C2C)OC(=O)CCSCCCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCSCCC(=O)OC1=C(C=C(C(=C1)C)SC2=CC(=C(C=C2C)OC(=O)CCSCCCCCCCCCCCCCC)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C56H94O4S3/c1-11-13-15-17-19-21-23-25-27-29-31-33-37-61-39-35-53(57)59-49-41-45(3)51(43-47(49)55(5,6)7)63-52-44-48(56(8,9)10)50(42-46(52)4)60-54(58)36-40-62-38-34-32-30-28-26-24-22-20-18-16-14-12-2/h41-44H,11-40H2,1-10H3