tert-butyl 4-[4-(trifluoromethylsulfonyloxy)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(trifluoromethylsulfonyloxy)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(trifluoromethylsulfonyloxy)phenyl]piperazine-1-carboxylate CAS Name: 4-[4-(trifluoromethylsulfonyloxy)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(trifluoromethylsulfonyloxy)phenyl]piperazine-1-carboxylate Traditional Name: 4-(4-triflyloxyphenyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H21F3N2O5S MolecularWeight: 410.40855

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H21F3N2O5S/c1-15(2,3)25-14(22)21-10-8-20(9-11-21)12-4-6-13(7-5-12)26-27(23,24)16(17,18)19/h4-7H,8-11H2,1-3H3