(2,5-diphenylpyrazol-3-yl) 3-(trifluoromethyl)benzenesulfonate

Systemtic Name: (2,5-diphenylpyrazol-3-yl) 3-(trifluoromethyl)benzenesulfonate Openeye Name: (2,5-diphenylpyrazol-3-yl) 3-(trifluoromethyl)benzenesulfonate CAS Name: 3-(trifluoromethyl)benzenesulfonic acid (2,5-diphenyl-3-pyrazolyl) ester IUPAC Name: (2,5-diphenylpyrazol-3-yl) 3-(trifluoromethyl)benzenesulfonate Traditional Name: 3-(trifluoromethyl)benzenesulfonic acid (2,5-diphenylpyrazol-3-yl) ester Formula: C22H15F3N2O3S MolecularWeight: 444.42631

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(=C2)OS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C(=C2)OS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C22H15F3N2O3S/c23-22(24,25)17-10-7-13-19(14-17)31(28,29)30-21-15-20(16-8-3-1-4-9-16)26-27(21)18-11-5-2-6-12-18/h1-15H