2-[[5-methyl-3-[(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanylmethyl]-2-oxidanyl-phenyl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[5-methyl-3-[(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanylmethyl]-2-oxidanyl-phenyl]methylsulfanyl]ethanoate Openeye Name: 2-[[2-hydroxy-5-methyl-3-[(2-oxido-2-oxo-ethyl)sulfanylmethyl]phenyl]methylsulfanyl]acetate CAS Name: 2-[[2-hydroxy-5-methyl-3-[[(2-oxido-2-oxoethyl)thio]methyl]phenyl]methylthio]acetate IUPAC Name: 2-[[2-hydroxy-5-methyl-3-[(2-oxido-2-oxoethyl)sulfanylmethyl]phenyl]methylsulfanyl]acetate Traditional Name: 2-[[2-hydroxy-3-[[(2-keto-2-oxido-ethyl)thio]methyl]-5-methyl-benzyl]thio]acetate Formula: C13H14O5S2-2 MolecularWeight: 314.37726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)CSCC(=O)[O-])O)CSCC(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)CSCC(=O)[O-])O)CSCC(=O)[O-]

InChI

InChI=1S/C13H16O5S2/c1-8-2-9(4-19-6-11(14)15)13(18)10(3-8)5-20-7-12(16)17/h2-3,18H,4-7H2,1H3,(H,14,15)(H,16,17)/p-2