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

Systemtic Name: tert-butyl 4-[2-(2-fluorophenyl)ethynyl]-4-oxidanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-fluorophenyl)ethynyl]-4-hydroxy-piperidine-1-carboxylate CAS Name: 4-[2-(2-fluorophenyl)ethynyl]-4-hydroxy-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2-fluorophenyl)ethynyl]-4-hydroxypiperidine-1-carboxylate Traditional Name: 4-[2-(2-fluorophenyl)ethynyl]-4-hydroxy-piperidine-1-carboxylic acid tert-butyl ester Formula: C18H22FNO3 MolecularWeight: 319.370583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FNO3/c1-17(2,3)23-16(21)20-12-10-18(22,11-13-20)9-8-14-6-4-5-7-15(14)19/h4-7,22H,10-13H2,1-3H3