tert-butyl 4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C16H21F3N2O4S MolecularWeight: 394.40915

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21F3N2O4S/c1-15(2,3)25-14(22)20-7-9-21(10-8-20)26(23,24)13-6-4-5-12(11-13)16(17,18)19/h4-6,11H,7-10H2,1-3H3