tert-butyl 4-fluoranyl-4-[2-(2-fluorophenyl)ethynyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-fluoranyl-4-[2-(2-fluorophenyl)ethynyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-fluoro-4-[2-(2-fluorophenyl)ethynyl]piperidine-1-carboxylate CAS Name: 4-fluoro-4-[2-(2-fluorophenyl)ethynyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-fluoro-4-[2-(2-fluorophenyl)ethynyl]piperidine-1-carboxylate Traditional Name: 4-fluoro-4-[2-(2-fluorophenyl)ethynyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H21F2NO2 MolecularWeight: 321.361646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(C#CC2=CC=CC=C2F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(C#CC2=CC=CC=C2F)F

InChI

InChI=1S/C18H21F2NO2/c1-17(2,3)23-16(22)21-12-10-18(20,11-13-21)9-8-14-6-4-5-7-15(14)19/h4-7H,10-13H2,1-3H3