tert-butyl 4-(cyanomethyl)-4-(4-fluorophenyl)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(cyanomethyl)-4-(4-fluorophenyl)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(cyanomethyl)-4-(4-fluorophenyl)piperidine-1-carboxylate CAS Name: 4-(cyanomethyl)-4-(4-fluorophenyl)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(cyanomethyl)-4-(4-fluorophenyl)piperidine-1-carboxylate Traditional Name: 4-(cyanomethyl)-4-(4-fluorophenyl)piperidine-1-carboxylic acid tert-butyl ester Formula: C18H23FN2O2 MolecularWeight: 318.385823

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23FN2O2/c1-17(2,3)23-16(22)21-12-9-18(8-11-20,10-13-21)14-4-6-15(19)7-5-14/h4-7H,8-10,12-13H2,1-3H3