methyl 3-(4-methylsulfonyloxypiperidin-1-yl)-5-(trifluoromethyl)benzoate

Systemtic Name: methyl 3-(4-methylsulfonyloxypiperidin-1-yl)-5-(trifluoromethyl)benzoate Openeye Name: methyl 3-(4-methylsulfonyloxy-1-piperidyl)-5-(trifluoromethyl)benzoate CAS Name: 3-(4-methylsulfonyloxy-1-piperidinyl)-5-(trifluoromethyl)benzoic acid methyl ester IUPAC Name: methyl 3-(4-methylsulfonyloxypiperidin-1-yl)-5-(trifluoromethyl)benzoate Traditional Name: 3-(4-methylsulfonyloxypiperidino)-5-(trifluoromethyl)benzoic acid methyl ester Formula: C15H18F3NO5S MolecularWeight: 381.36733

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)N2CCC(CC2)OS(=O)(=O)C)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)N2CCC(CC2)OS(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C15H18F3NO5S/c1-23-14(20)10-7-11(15(16,17)18)9-12(8-10)19-5-3-13(4-6-19)24-25(2,21)22/h7-9,13H,3-6H2,1-2H3