[3-[2,3-bis(oxidanyl)propylsulfanylmethyl]-4-oxidanylidene-cyclopentyl]methyl ethanoate

Systemtic Name: [3-[2,3-bis(oxidanyl)propylsulfanylmethyl]-4-oxidanylidene-cyclopentyl]methyl ethanoate Openeye Name: [3-(2,3-dihydroxypropylsulfanylmethyl)-4-oxo-cyclopentyl]methyl acetate CAS Name: acetic acid [3-[(2,3-dihydroxypropylthio)methyl]-4-oxocyclopentyl]methyl ester IUPAC Name: [3-(2,3-dihydroxypropylsulfanylmethyl)-4-oxocyclopentyl]methyl acetate Traditional Name: acetic acid [3-[(glycerylthio)methyl]-4-keto-cyclopentyl]methyl ester Formula: C12H20O5S MolecularWeight: 276.3492

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1CC(C(=O)C1)CSCC(CO)O

Isomeric SMILES

CC(=O)OCC1CC(C(=O)C1)CSCC(CO)O

InChI

InChI=1S/C12H20O5S/c1-8(14)17-5-9-2-10(12(16)3-9)6-18-7-11(15)4-13/h9-11,13,15H,2-7H2,1H3