(2R,4S)-1-(2-tert-butylsulfanylethanoyl)-4-methoxy-pyrrolidine-2-carboxylate

Systemtic Name: (2R,4S)-1-(2-tert-butylsulfanylethanoyl)-4-methoxy-pyrrolidine-2-carboxylate Openeye Name: (2R,4S)-1-(2-tert-butylsulfanylacetyl)-4-methoxy-pyrrolidine-2-carboxylate CAS Name: (2R,4S)-1-[2-(tert-butylthio)-1-oxoethyl]-4-methoxy-2-pyrrolidinecarboxylate IUPAC Name: (2R,4S)-1-(2-tert-butylsulfanylacetyl)-4-methoxypyrrolidine-2-carboxylate Traditional Name: (2R,4S)-1-[2-(tert-butylthio)acetyl]-4-methoxy-pyrrolidine-2-carboxylate Formula: C12H20NO4S- MolecularWeight: 274.3565

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(=O)N1CC(CC1C(=O)[O-])OC

Isomeric SMILES

CC(C)(C)SCC(=O)N1C[C@H](C[C@@H]1C(=O)[O-])OC

InChI

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