[4-[4-(trifluoromethyloxy)phenoxy]piperidin-1-yl]sulfonyl 1-methylpiperidine-4-carboxylate

Systemtic Name: [4-[4-(trifluoromethyloxy)phenoxy]piperidin-1-yl]sulfonyl 1-methylpiperidine-4-carboxylate Openeye Name: [4-[4-(trifluoromethoxy)phenoxy]-1-piperidyl]sulfonyl 1-methylpiperidine-4-carboxylate CAS Name: 1-methyl-4-piperidinecarboxylic acid [4-[4-(trifluoromethoxy)phenoxy]-1-piperidinyl]sulfonyl ester IUPAC Name: [4-[4-(trifluoromethoxy)phenoxy]piperidin-1-yl]sulfonyl 1-methylpiperidine-4-carboxylate Traditional Name: 1-methylisonipecotic acid [4-[4-(trifluoromethoxy)phenoxy]piperidino]sulfonyl ester Formula: C19H25F3N2O6S MolecularWeight: 466.47181

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C(=O)OS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

CN1CCC(CC1)C(=O)OS(=O)(=O)N2CCC(CC2)OC3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C19H25F3N2O6S/c1-23-10-6-14(7-11-23)18(25)30-31(26,27)24-12-8-16(9-13-24)28-15-2-4-17(5-3-15)29-19(20,21)22/h2-5,14,16H,6-13H2,1H3