[2-hexadecanoyloxy-3-[2-[(4-methoxyphenyl)methoxy]-2-oxidanylidene-ethyl]sulfanyl-propyl] hexadecanoate

Systemtic Name: [2-hexadecanoyloxy-3-[2-[(4-methoxyphenyl)methoxy]-2-oxidanylidene-ethyl]sulfanyl-propyl] hexadecanoate Openeye Name: [2-hexadecanoyloxy-3-[2-[(4-methoxyphenyl)methoxy]-2-oxo-ethyl]sulfanyl-propyl] hexadecanoate CAS Name: hexadecanoic acid [3-[[2-[(4-methoxyphenyl)methoxy]-2-oxoethyl]thio]-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [2-hexadecanoyloxy-3-[2-[(4-methoxyphenyl)methoxy]-2-oxoethyl]sulfanylpropyl] hexadecanoate Traditional Name: palmitic acid [2-hexadecanoyloxy-3-[(2-keto-2-p-anisyloxy-ethyl)thio]propyl] ester Formula: C45H78O7S MolecularWeight: 763.16162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(CSCC(=O)OCC1=CC=C(C=C1)OC)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(CSCC(=O)OCC1=CC=C(C=C1)OC)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C45H78O7S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-43(46)51-37-42(38-53-39-45(48)50-36-40-32-34-41(49-3)35-33-40)52-44(47)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h32-35,42H,4-31,36-39H2,1-3H3