[1-methyl-4-(trifluoromethyl)piperidin-3-yl]methyl benzenesulfonate

Systemtic Name: [1-methyl-4-(trifluoromethyl)piperidin-3-yl]methyl benzenesulfonate Openeye Name: [1-methyl-4-(trifluoromethyl)-3-piperidyl]methyl benzenesulfonate CAS Name: benzenesulfonic acid [1-methyl-4-(trifluoromethyl)-3-piperidinyl]methyl ester IUPAC Name: [1-methyl-4-(trifluoromethyl)piperidin-3-yl]methyl benzenesulfonate Traditional Name: benzenesulfonic acid [1-methyl-4-(trifluoromethyl)-3-piperidyl]methyl ester Formula: C14H18F3NO3S MolecularWeight: 337.35783

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)COS(=O)(=O)C2=CC=CC=C2)C(F)(F)F

Isomeric SMILES

CN1CCC(C(C1)COS(=O)(=O)C2=CC=CC=C2)C(F)(F)F

InChI

InChI=1S/C14H18F3NO3S/c1-18-8-7-13(14(15,16)17)11(9-18)10-21-22(19,20)12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3