cyanomethyl (3S)-5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate

Systemtic Name: cyanomethyl (3S)-5-oxidanylidene-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Openeye Name: cyanomethyl (3S)-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate CAS Name: (3S)-5-oxo-1-[3-(trifluoromethyl)phenyl]-3-pyrrolidinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl (3S)-5-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylate Traditional Name: (3S)-5-keto-1-[3-(trifluoromethyl)phenyl]pyrrolidine-3-carboxylic acid cyanomethyl ester Formula: C14H11F3N2O3 MolecularWeight: 312.24395

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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#N

Isomeric SMILES

C1[C@@H](CN(C1=O)C2=CC=CC(=C2)C(F)(F)F)C(=O)OCC#N

InChI

InChI=1S/C14H11F3N2O3/c15-14(16,17)10-2-1-3-11(7-10)19-8-9(6-12(19)20)13(21)22-5-4-18/h1-3,7,9H,5-6,8H2/t9-/m0/s1