tert-butyl 2-(2-cyanopyrrolidin-1-yl)carbonyl-4-[[4-(trifluoromethyl)phenyl]carbonylamino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-(2-cyanopyrrolidin-1-yl)carbonyl-4-[[4-(trifluoromethyl)phenyl]carbonylamino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-(2-cyanopyrrolidine-1-carbonyl)-4-[[4-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxylate CAS Name: 2-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-4-[[oxo-[4-(trifluoromethyl)phenyl]methyl]amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-cyanopyrrolidine-1-carbonyl)-4-[[4-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxylate Traditional Name: 2-(2-cyanopyrrolidine-1-carbonyl)-4-[[4-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H27F3N4O4 MolecularWeight: 480.48009

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2C#N)NC(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2C#N)NC(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C23H27F3N4O4/c1-22(2,3)34-21(33)30-13-16(11-18(30)20(32)29-10-4-5-17(29)12-27)28-19(31)14-6-8-15(9-7-14)23(24,25)26/h6-9,16-18H,4-5,10-11,13H2,1-3H3,(H,28,31)