(2S,3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(methylsulfanylmethyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S,3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(methylsulfanylmethyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S,3R)-1-tert-butoxycarbonyl-3-(methylsulfanylmethyl)pyrrolidine-2-carboxylic acid CAS Name: (2S,3R)-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-[(methylthio)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S,3R)-1-[(2-methylpropan-2-yl)oxycarbonyl]-3-(methylsulfanylmethyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S,3R)-1-tert-butoxycarbonyl-3-[(methylthio)methyl]proline Formula: C12H21NO4S MolecularWeight: 275.36444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1C(=O)O)CSC

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H]([C@H]1C(=O)O)CSC

InChI

InChI=1S/C12H21NO4S/c1-12(2,3)17-11(16)13-6-5-8(7-18-4)9(13)10(14)15/h8-9H,5-7H2,1-4H3,(H,14,15)/t8-,9-/m0/s1