tert-butyl 4-(4-cyano-3-fluoranyl-phenoxy)piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-cyano-3-fluoranyl-phenoxy)piperidine-1-carboxylate Openeye Name: tert-butyl 4-(4-cyano-3-fluoro-phenoxy)piperidine-1-carboxylate CAS Name: 4-(4-cyano-3-fluorophenoxy)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-cyano-3-fluorophenoxy)piperidine-1-carboxylate Traditional Name: 4-(4-cyano-3-fluoro-phenoxy)piperidine-1-carboxylic acid tert-butyl ester Formula: C17H21FN2O3 MolecularWeight: 320.358643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC(=C(C=C2)C#N)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C17H21FN2O3/c1-17(2,3)23-16(21)20-8-6-13(7-9-20)22-14-5-4-12(11-19)15(18)10-14/h4-5,10,13H,6-9H2,1-3H3