2-(3-methylsulfanylpropyl)-3-oxidanyl-butanedioate

Systemtic Name: 2-(3-methylsulfanylpropyl)-3-oxidanyl-butanedioate Openeye Name: 2-hydroxy-3-(3-methylsulfanylpropyl)butanedioate CAS Name: 2-hydroxy-3-[3-(methylthio)propyl]butanedioate IUPAC Name: 2-hydroxy-3-(3-methylsulfanylpropyl)butanedioate Traditional Name: 2-hydroxy-3-[3-(methylthio)propyl]succinate Formula: C8H12O5S-2 MolecularWeight: 220.24288

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCC(C(C(=O)[O-])O)C(=O)[O-]

Isomeric SMILES

CSCCCC(C(C(=O)[O-])O)C(=O)[O-]

InChI

InChI=1S/C8H14O5S/c1-14-4-2-3-5(7(10)11)6(9)8(12)13/h5-6,9H,2-4H2,1H3,(H,10,11)(H,12,13)/p-2