[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl] benzenesulfonate

Systemtic Name: [5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl] benzenesulfonate Openeye Name: [5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl] ester IUPAC Name: [5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl] ester Formula: C19H19FN2O3S MolecularWeight: 374.429163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19FN2O3S/c1-19(2,3)17-13-18(22(21-17)15-11-9-14(20)10-12-15)25-26(23,24)16-7-5-4-6-8-16/h4-13H,1-3H3