tert-butyl 3-[cyclohexyl-[2-(trifluoromethyl)phenyl]carbonyl-amino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[cyclohexyl-[2-(trifluoromethyl)phenyl]carbonyl-amino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[cyclohexyl-[2-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxylate CAS Name: 3-[cyclohexyl-[oxo-[2-(trifluoromethyl)phenyl]methyl]amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[cyclohexyl-[2-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxylate Traditional Name: 3-[cyclohexyl-[2-(trifluoromethyl)benzoyl]amino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H31F3N2O3 MolecularWeight: 440.49905

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)N(C2CCCCC2)C(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)N(C2CCCCC2)C(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C23H31F3N2O3/c1-22(2,3)31-21(30)27-14-13-17(15-27)28(16-9-5-4-6-10-16)20(29)18-11-7-8-12-19(18)23(24,25)26/h7-8,11-12,16-17H,4-6,9-10,13-15H2,1-3H3