(1-cyanoindolizin-2-yl)methyl 2-oxidanylidene-1-[3-(trifluoromethyloxy)phenyl]pyrrolidine-3-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 2-oxidanylidene-1-[3-(trifluoromethyloxy)phenyl]pyrrolidine-3-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 2-oxo-1-[3-(trifluoromethoxy)phenyl]pyrrolidine-3-carboxylate CAS Name: 2-oxo-1-[3-(trifluoromethoxy)phenyl]-3-pyrrolidinecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 2-oxo-1-[3-(trifluoromethoxy)phenyl]pyrrolidine-3-carboxylate Traditional Name: 2-keto-1-[3-(trifluoromethoxy)phenyl]pyrrolidine-3-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C22H16F3N3O4 MolecularWeight: 443.37535

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)C1C(=O)OCC2=CN3C=CC=CC3=C2C#N)C4=CC(=CC=C4)OC(F)(F)F

Isomeric SMILES

C1CN(C(=O)C1C(=O)OCC2=CN3C=CC=CC3=C2C#N)C4=CC(=CC=C4)OC(F)(F)F

InChI

InChI=1S/C22H16F3N3O4/c23-22(24,25)32-16-5-3-4-15(10-16)28-9-7-17(20(28)29)21(30)31-13-14-12-27-8-2-1-6-19(27)18(14)11-26/h1-6,8,10,12,17H,7,9,13H2