[2-(trifluoromethyl)phenyl] 4-piperidin-1-ylsulfonylbenzenesulfonate

Systemtic Name: [2-(trifluoromethyl)phenyl] 4-piperidin-1-ylsulfonylbenzenesulfonate Openeye Name: [2-(trifluoromethyl)phenyl] 4-(1-piperidylsulfonyl)benzenesulfonate CAS Name: 4-(1-piperidinylsulfonyl)benzenesulfonic acid [2-(trifluoromethyl)phenyl] ester IUPAC Name: [2-(trifluoromethyl)phenyl] 4-piperidin-1-ylsulfonylbenzenesulfonate Traditional Name: 4-piperidinosulfonylbenzenesulfonic acid [2-(trifluoromethyl)phenyl] ester Formula: C18H18F3NO5S2 MolecularWeight: 449.46443

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)OC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H18F3NO5S2/c19-18(20,21)16-6-2-3-7-17(16)27-29(25,26)15-10-8-14(9-11-15)28(23,24)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13H2