[1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl] methanesulfonate

Systemtic Name: [1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl] methanesulfonate Openeye Name: [1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl] methanesulfonate CAS Name: methanesulfonic acid [1-[5-(trifluoromethyl)-2-pyridinyl]-4-piperidinyl] ester IUPAC Name: [1-[5-(trifluoromethyl)pyridin-2-yl]piperidin-4-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[5-(trifluoromethyl)-2-pyridyl]-4-piperidyl] ester Formula: C12H15F3N2O3S MolecularWeight: 324.31931

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)OC1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C12H15F3N2O3S/c1-21(18,19)20-10-4-6-17(7-5-10)11-3-2-9(8-16-11)12(13,14)15/h2-3,8,10H,4-7H2,1H3