tert-butyl 4-(cyanomethyl)-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(cyanomethyl)-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-(cyanomethyl)-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate CAS Name: 4-(cyanomethyl)-4-[4-(trifluoromethyl)phenyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(cyanomethyl)-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylate Traditional Name: 4-(cyanomethyl)-4-[4-(trifluoromethyl)phenyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H23F3N2O2 MolecularWeight: 368.39333

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(CC#N)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(CC#N)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C19H23F3N2O2/c1-17(2,3)26-16(25)24-12-9-18(8-11-23,10-13-24)14-4-6-15(7-5-14)19(20,21)22/h4-7H,8-10,12-13H2,1-3H3