tert-butyl 2-[4-(methylsulfonylaminomethyl)piperidin-1-yl]sulfonyl-5-(trifluoromethyloxy)benzoate

Systemtic Name: tert-butyl 2-[4-(methylsulfonylaminomethyl)piperidin-1-yl]sulfonyl-5-(trifluoromethyloxy)benzoate Openeye Name: tert-butyl 2-[[4-(methanesulfonamidomethyl)-1-piperidyl]sulfonyl]-5-(trifluoromethoxy)benzoate CAS Name: 2-[[4-(methanesulfonamidomethyl)-1-piperidinyl]sulfonyl]-5-(trifluoromethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(methanesulfonamidomethyl)piperidin-1-yl]sulfonyl-5-(trifluoromethoxy)benzoate Traditional Name: 2-[4-(methanesulfonamidomethyl)piperidino]sulfonyl-5-(trifluoromethoxy)benzoic acid tert-butyl ester Formula: C19H27F3N2O7S2 MolecularWeight: 516.55209

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)OC(F)(F)F)S(=O)(=O)N2CCC(CC2)CNS(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)OC(F)(F)F)S(=O)(=O)N2CCC(CC2)CNS(=O)(=O)C

InChI

InChI=1S/C19H27F3N2O7S2/c1-18(2,3)31-17(25)15-11-14(30-19(20,21)22)5-6-16(15)33(28,29)24-9-7-13(8-10-24)12-23-32(4,26)27/h5-6,11,13,23H,7-10,12H2,1-4H3