ethyl 1-pyridin-2-yl-5-[5-(trifluoromethylsulfonyloxy)pyridin-2-yl]pyrazole-3-carboxylate

Systemtic Name: ethyl 1-pyridin-2-yl-5-[5-(trifluoromethylsulfonyloxy)pyridin-2-yl]pyrazole-3-carboxylate Openeye Name: ethyl 1-(2-pyridyl)-5-[5-(trifluoromethylsulfonyloxy)-2-pyridyl]pyrazole-3-carboxylate CAS Name: 1-(2-pyridinyl)-5-[5-(trifluoromethylsulfonyloxy)-2-pyridinyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-pyridin-2-yl-5-[5-(trifluoromethylsulfonyloxy)pyridin-2-yl]pyrazole-3-carboxylate Traditional Name: 1-(2-pyridyl)-5-(5-triflyloxy-2-pyridyl)pyrazole-3-carboxylic acid ethyl ester Formula: C17H13F3N4O5S MolecularWeight: 442.36913

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=C1)C2=NC=C(C=C2)OS(=O)(=O)C(F)(F)F)C3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=NN(C(=C1)C2=NC=C(C=C2)OS(=O)(=O)C(F)(F)F)C3=CC=CC=N3

InChI

InChI=1S/C17H13F3N4O5S/c1-2-28-16(25)13-9-14(24(23-13)15-5-3-4-8-21-15)12-7-6-11(10-22-12)29-30(26,27)17(18,19)20/h3-10H,2H2,1H3