[2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2-methyl-1-(p-tolylsulfonyl)-2,3-dihydropyrrol-5-yl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl] ester IUPAC Name: [2-methyl-1-(4-methylphenyl)sulfonyl-2,3-dihydropyrrol-5-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (5-methyl-1-tosyl-2-pyrrolin-2-yl) ester Formula: C13H14F3NO5S2 MolecularWeight: 385.37917

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC=C(N1S(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1CC=C(N1S(=O)(=O)C2=CC=C(C=C2)C)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C13H14F3NO5S2/c1-9-3-6-11(7-4-9)23(18,19)17-10(2)5-8-12(17)22-24(20,21)13(14,15)16/h3-4,6-8,10H,5H2,1-2H3