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

Systemtic Name: [2-methyl-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-pyridin-6-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2-methyl-1-(p-tolylsulfonyl)-3,4-dihydro-2H-pyridin-6-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-methyl-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-pyridin-6-yl] ester IUPAC Name: [2-methyl-1-(4-methylphenyl)sulfonyl-3,4-dihydro-2H-pyridin-6-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2-methyl-1-tosyl-3,4-dihydro-2H-pyridin-6-yl) ester Formula: C14H16F3NO5S2 MolecularWeight: 399.40575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC=C(N1S(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1CCC=C(N1S(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C14H16F3NO5S2/c1-10-6-8-12(9-7-10)24(19,20)18-11(2)4-3-5-13(18)23-25(21,22)14(15,16)17/h5-9,11H,3-4H2,1-2H3