[1-(4-methylphenyl)sulfonyl-4-propan-2-yl-3,4-dihydro-2H-pyridin-6-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [1-(4-methylphenyl)sulfonyl-4-propan-2-yl-3,4-dihydro-2H-pyridin-6-yl] tris(fluoranyl)methanesulfonate Openeye Name: [4-isopropyl-1-(p-tolylsulfonyl)-3,4-dihydro-2H-pyridin-6-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [1-(4-methylphenyl)sulfonyl-4-propan-2-yl-3,4-dihydro-2H-pyridin-6-yl] ester IUPAC Name: [1-(4-methylphenyl)sulfonyl-4-propan-2-yl-3,4-dihydro-2H-pyridin-6-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4-isopropyl-1-tosyl-3,4-dihydro-2H-pyridin-6-yl) ester Formula: C16H20F3NO5S2 MolecularWeight: 427.45891

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C=C2OS(=O)(=O)C(F)(F)F)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(C=C2OS(=O)(=O)C(F)(F)F)C(C)C

InChI

InChI=1S/C16H20F3NO5S2/c1-11(2)13-8-9-20(15(10-13)25-27(23,24)16(17,18)19)26(21,22)14-6-4-12(3)5-7-14/h4-7,10-11,13H,8-9H2,1-3H3