tert-butyl (2S)-2-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[oxo-[4-(trifluoromethyl)anilino]methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[[4-(trifluoromethyl)phenyl]carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C17H21F3N2O3 MolecularWeight: 358.35545

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H21F3N2O3/c1-16(2,3)25-15(24)22-10-4-5-13(22)14(23)21-12-8-6-11(7-9-12)17(18,19)20/h6-9,13H,4-5,10H2,1-3H3,(H,21,23)/t13-/m0/s1