[2-methyl-1-(3-methylpyridin-2-yl)-6-oxidanylidene-pyridin-4-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-methyl-1-(3-methylpyridin-2-yl)-6-oxidanylidene-pyridin-4-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2-methyl-1-(3-methyl-2-pyridyl)-6-oxo-4-pyridyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-methyl-1-(3-methyl-2-pyridinyl)-6-oxo-4-pyridinyl] ester IUPAC Name: [2-methyl-1-(3-methylpyridin-2-yl)-6-oxopyridin-4-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-keto-6-methyl-1-(3-methyl-2-pyridyl)-4-pyridyl] ester Formula: C13H11F3N2O4S MolecularWeight: 348.29765

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)N2C(=CC(=CC2=O)OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CC1=C(N=CC=C1)N2C(=CC(=CC2=O)OS(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C13H11F3N2O4S/c1-8-4-3-5-17-12(8)18-9(2)6-10(7-11(18)19)22-23(20,21)13(14,15)16/h3-7H,1-2H3