(2R,3S)-3-methylsulfanyl-1-(phenylmethyl)peroxycarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,3S)-3-methylsulfanyl-1-(phenylmethyl)peroxycarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: (2R,3S)-1-benzylperoxycarbonyl-3-methylsulfanyl-pyrrolidine-2-carboxylic acid CAS Name: (2R,3S)-3-(methylthio)-1-[oxo-(phenylmethyl)dioxymethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,3S)-1-benzylperoxycarbonyl-3-methylsulfanylpyrrolidine-2-carboxylic acid Traditional Name: (2R,3S)-1-benzylperoxycarbonyl-3-(methylthio)proline Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

CSC1CCN(C1C(=O)O)C(=O)OOCC2=CC=CC=C2

Isomeric SMILES

CS[C@H]1CCN([C@@H]1C(=O)O)C(=O)OOCC2=CC=CC=C2

InChI

InChI=1S/C14H17NO5S/c1-21-11-7-8-15(12(11)13(16)17)14(18)20-19-9-10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3,(H,16,17)/t11-,12-/m0/s1