ethyl 4-[4-fluoranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-fluoranyl-3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-fluoro-3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-fluoro-3-(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-fluoro-3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-fluoro-3-(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C14H16F4N2O4S MolecularWeight: 384.346453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16F4N2O4S/c1-2-24-13(21)19-5-7-20(8-6-19)25(22,23)10-3-4-12(15)11(9-10)14(16,17)18/h3-4,9H,2,5-8H2,1H3