tert-butyl 2-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-2-phenyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-2-phenyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-2-phenyl-pyrrolidine-1-carboxylate CAS Name: 2-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-2-phenyl-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-2-phenylpyrrolidine-1-carboxylate Traditional Name: 2-[[3,5-bis(trifluoromethyl)benzyl]oxymethyl]-2-phenyl-pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H27F6NO3 MolecularWeight: 503.477199

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C25H27F6NO3/c1-22(2,3)35-21(33)32-11-7-10-23(32,18-8-5-4-6-9-18)16-34-15-17-12-19(24(26,27)28)14-20(13-17)25(29,30)31/h4-6,8-9,12-14H,7,10-11,15-16H2,1-3H3