(3S)-1-(4-methylsulfanylphenyl)-2-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: (3S)-1-(4-methylsulfanylphenyl)-2-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: (3S)-1-(4-methylsulfanylphenyl)-2-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-[4-(methylthio)phenyl]-2-oxo-3-pyrrolidinecarboxylate IUPAC Name: (3S)-1-(4-methylsulfanylphenyl)-2-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-2-keto-1-[4-(methylthio)phenyl]pyrrolidine-3-carboxylate Formula: C12H12NO3S- MolecularWeight: 250.29358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2CCC(C2=O)C(=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)N2CC[C@@H](C2=O)C(=O)[O-]

InChI

InChI=1S/C12H13NO3S/c1-17-9-4-2-8(3-5-9)13-7-6-10(11(13)14)12(15)16/h2-5,10H,6-7H2,1H3,(H,15,16)/p-1/t10-/m0/s1