2-ethylhexyl 3-ethyl-3-[2-(trioxidanylsulfanyl)ethanoyloxymethyl]heptanoate

Systemtic Name: 2-ethylhexyl 3-ethyl-3-[2-(trioxidanylsulfanyl)ethanoyloxymethyl]heptanoate Openeye Name: 2-ethylhexyl 3-ethyl-3-[[2-(trioxidanylsulfanyl)acetyl]oxymethyl]heptanoate CAS Name: 3-ethyl-3-[[1-oxo-2-(trioxidanylthio)ethoxy]methyl]heptanoic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl 3-ethyl-3-[[2-(trioxidanylsulfanyl)acetyl]oxymethyl]heptanoate Traditional Name: 3-ethyl-3-[[2-(trioxidanylthio)acetyl]oxymethyl]enanthic acid 2-ethylhexyl ester Formula: C20H38O7S MolecularWeight: 422.57652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CC(CC)(CCCC)COC(=O)CSOOO

Isomeric SMILES

CCCCC(CC)COC(=O)CC(CC)(CCCC)COC(=O)CSOOO

InChI

InChI=1S/C20H38O7S/c1-5-9-11-17(7-3)14-24-18(21)13-20(8-4,12-10-6-2)16-25-19(22)15-28-27-26-23/h17,23H,5-16H2,1-4H3