(2-oxidanylidene-2-phenylazanyl-ethyl) (3S)-5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (3S)-5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Openeye Name: (2-anilino-2-oxo-ethyl) (3S)-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (3S)-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid (2-anilino-2-keto-ethyl) ester Formula: C20H17F3N2O4 MolecularWeight: 406.35519

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)C2=CC=CC(=C2)C(F)(F)F)C(=O)OCC(=O)NC3=CC=CC=C3

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=CC(=C2)C(F)(F)F)C(=O)OCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H17F3N2O4/c21-20(22,23)14-5-4-8-16(10-14)25-11-13(9-18(25)27)19(28)29-12-17(26)24-15-6-2-1-3-7-15/h1-8,10,13H,9,11-12H2,(H,24,26)/t13-/m0/s1