(2S,4R)-1-(2-methylsulfanylethanoyl)-4-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: (2S,4R)-1-(2-methylsulfanylethanoyl)-4-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: (2S,4R)-4-hydroxy-1-(2-methylsulfanylacetyl)pyrrolidine-2-carboxylate CAS Name: (2S,4R)-4-hydroxy-1-[2-(methylthio)-1-oxoethyl]-2-pyrrolidinecarboxylate IUPAC Name: (2S,4R)-4-hydroxy-1-(2-methylsulfanylacetyl)pyrrolidine-2-carboxylate Traditional Name: (2S,4R)-4-hydroxy-1-[2-(methylthio)acetyl]pyrrolidine-2-carboxylate Formula: C8H12NO4S- MolecularWeight: 218.25018

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Descriptors Computed from Structure

Canonical SMILES:

CSCC(=O)N1CC(CC1C(=O)[O-])O

Isomeric SMILES

CSCC(=O)N1C[C@@H](C[C@H]1C(=O)[O-])O

InChI

InChI=1S/C8H13NO4S/c1-14-4-7(11)9-3-5(10)2-6(9)8(12)13/h5-6,10H,2-4H2,1H3,(H,12,13)/p-1/t5-,6+/m1/s1