ethyl 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C15H16F6N2O4S MolecularWeight: 434.353959

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16F6N2O4S/c1-2-27-13(24)22-3-5-23(6-4-22)28(25,26)12-8-10(14(16,17)18)7-11(9-12)15(19,20)21/h7-9H,2-6H2,1H3