[5-(4-methoxyphenyl)-1-methyl-2-oxidanylidene-6-pyridin-4-yl-pyridin-3-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [5-(4-methoxyphenyl)-1-methyl-2-oxidanylidene-6-pyridin-4-yl-pyridin-3-yl] tris(fluoranyl)methanesulfonate Openeye Name: [5-(4-methoxyphenyl)-1-methyl-2-oxo-6-(4-pyridyl)-3-pyridyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [5-(4-methoxyphenyl)-1-methyl-2-oxo-6-pyridin-4-yl-3-pyridinyl] ester IUPAC Name: [5-(4-methoxyphenyl)-1-methyl-2-oxo-6-pyridin-4-ylpyridin-3-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-keto-5-(4-methoxyphenyl)-1-methyl-6-(4-pyridyl)-3-pyridyl] ester Formula: C19H15F3N2O5S MolecularWeight: 440.39301

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=C(C1=O)OS(=O)(=O)C(F)(F)F)C2=CC=C(C=C2)OC)C3=CC=NC=C3

Isomeric SMILES

CN1C(=C(C=C(C1=O)OS(=O)(=O)C(F)(F)F)C2=CC=C(C=C2)OC)C3=CC=NC=C3

InChI

InChI=1S/C19H15F3N2O5S/c1-24-17(13-7-9-23-10-8-13)15(12-3-5-14(28-2)6-4-12)11-16(18(24)25)29-30(26,27)19(20,21)22/h3-11H,1-2H3