methyl (3S)-2-oxidanylidene-4-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate

Systemtic Name: methyl (3S)-2-oxidanylidene-4-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Openeye Name: methyl (3S)-2-oxo-4-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate CAS Name: (3S)-2-oxo-4-[2-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (3S)-2-oxo-4-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-2-keto-4-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid methyl ester Formula: C13H12F3NO3 MolecularWeight: 287.23449

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(CNC1=O)C2=CC=CC=C2C(F)(F)F

Isomeric SMILES

COC(=O)[C@H]1C(CNC1=O)C2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H12F3NO3/c1-20-12(19)10-8(6-17-11(10)18)7-4-2-3-5-9(7)13(14,15)16/h2-5,8,10H,6H2,1H3,(H,17,18)/t8?,10-/m0/s1