[1-(2-ethylhexoxy)-3-sulfanyl-propan-2-yl] 3-oxidanylidenebutanoate

Systemtic Name: [1-(2-ethylhexoxy)-3-sulfanyl-propan-2-yl] 3-oxidanylidenebutanoate Openeye Name: [1-(2-ethylhexoxymethyl)-2-sulfanyl-ethyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [1-(2-ethylhexoxy)-3-mercaptopropan-2-yl] ester IUPAC Name: [1-(2-ethylhexoxy)-3-sulfanylpropan-2-yl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [1-(2-ethylhexoxymethyl)-2-mercapto-ethyl] ester Formula: C15H28O4S MolecularWeight: 304.44542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC(CS)OC(=O)CC(=O)C

Isomeric SMILES

CCCCC(CC)COCC(CS)OC(=O)CC(=O)C

InChI

InChI=1S/C15H28O4S/c1-4-6-7-13(5-2)9-18-10-14(11-20)19-15(17)8-12(3)16/h13-14,20H,4-11H2,1-3H3