methyl 3-[2-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-3-oxidanyl-cyclopentyl]sulfanylpropanoate

Systemtic Name: methyl 3-[2-(3-methoxy-3-oxidanylidene-propyl)sulfanyl-3-oxidanyl-cyclopentyl]sulfanylpropanoate Openeye Name: methyl 3-[3-hydroxy-2-(3-methoxy-3-oxo-propyl)sulfanyl-cyclopentyl]sulfanylpropanoate CAS Name: 3-[[3-hydroxy-2-[(3-methoxy-3-oxopropyl)thio]cyclopentyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-hydroxy-2-(3-methoxy-3-oxopropyl)sulfanylcyclopentyl]sulfanylpropanoate Traditional Name: 3-[[3-hydroxy-2-[(3-keto-3-methoxy-propyl)thio]cyclopentyl]thio]propionic acid methyl ester Formula: C13H22O5S2 MolecularWeight: 322.44078

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1CCC(C1SCCC(=O)OC)O

Isomeric SMILES

COC(=O)CCSC1CCC(C1SCCC(=O)OC)O

InChI

InChI=1S/C13H22O5S2/c1-17-11(15)5-7-19-10-4-3-9(14)13(10)20-8-6-12(16)18-2/h9-10,13-14H,3-8H2,1-2H3