octadecyl 2-methyl-2-(2-methyl-1-octadecoxy-1-oxidanylidene-propan-2-yl)sulfanyl-propanoate

Systemtic Name: octadecyl 2-methyl-2-(2-methyl-1-octadecoxy-1-oxidanylidene-propan-2-yl)sulfanyl-propanoate Openeye Name: octadecyl 2-(1,1-dimethyl-2-octadecoxy-2-oxo-ethyl)sulfanyl-2-methyl-propanoate CAS Name: 2-methyl-2-[(2-methyl-1-octadecoxy-1-oxopropan-2-yl)thio]propanoic acid octadecyl ester IUPAC Name: octadecyl 2-methyl-2-(2-methyl-1-octadecoxy-1-oxopropan-2-yl)sulfanylpropanoate Traditional Name: 2-[(2-keto-1,1-dimethyl-2-stearyloxy-ethyl)thio]-2-methyl-propionic acid stearyl ester Formula: C44H86O4S MolecularWeight: 711.21624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)SC(C)(C)C(=O)OCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)SC(C)(C)C(=O)OCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C44H86O4S/c1-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-47-41(45)43(3,4)49-44(5,6)42(46)48-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-2/h7-40H2,1-6H3