[oxidanyl-[3-oxidanylidene-2-(2-oxidanylpropylsulfanylmethyl)cyclohexyl]methyl] ethanoate

Systemtic Name: [oxidanyl-[3-oxidanylidene-2-(2-oxidanylpropylsulfanylmethyl)cyclohexyl]methyl] ethanoate Openeye Name: [hydroxy-[2-(2-hydroxypropylsulfanylmethyl)-3-oxo-cyclohexyl]methyl] acetate CAS Name: acetic acid [hydroxy-[2-[(2-hydroxypropylthio)methyl]-3-oxocyclohexyl]methyl] ester IUPAC Name: [hydroxy-[2-(2-hydroxypropylsulfanylmethyl)-3-oxocyclohexyl]methyl] acetate Traditional Name: acetic acid [hydroxy-[2-[(2-hydroxypropylthio)methyl]-3-keto-cyclohexyl]methyl] ester Formula: C13H22O5S MolecularWeight: 290.37578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1C(CCCC1=O)C(O)OC(=O)C)O

Isomeric SMILES

CC(CSCC1C(CCCC1=O)C(O)OC(=O)C)O

InChI

InChI=1S/C13H22O5S/c1-8(14)6-19-7-11-10(4-3-5-12(11)16)13(17)18-9(2)15/h8,10-11,13-14,17H,3-7H2,1-2H3