tert-butyl 4-[3,4-bis(fluoranyl)phenyl]-4-(cyanomethyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3,4-bis(fluoranyl)phenyl]-4-(cyanomethyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(cyanomethyl)-4-(3,4-difluorophenyl)piperidine-1-carboxylate CAS Name: 4-(cyanomethyl)-4-(3,4-difluorophenyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(cyanomethyl)-4-(3,4-difluorophenyl)piperidine-1-carboxylate Traditional Name: 4-(cyanomethyl)-4-(3,4-difluorophenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C18H22F2N2O2 MolecularWeight: 336.376286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22F2N2O2/c1-17(2,3)24-16(23)22-10-7-18(6-9-21,8-11-22)13-4-5-14(19)15(20)12-13/h4-5,12H,6-8,10-11H2,1-3H3