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

Systemtic Name: [2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl] benzenesulfonate Openeye Name: [2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl] benzenesulfonate CAS Name: benzenesulfonic acid [2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(4-fluorophenyl)-5-phenylpyrazol-3-yl] benzenesulfonate Traditional Name: benzenesulfonic acid [2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C21H15FN2O3S MolecularWeight: 394.418803

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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)C4=CC=C(C=C4)F

Isomeric SMILES

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

InChI

InChI=1S/C21H15FN2O3S/c22-17-11-13-18(14-12-17)24-21(15-20(23-24)16-7-3-1-4-8-16)27-28(25,26)19-9-5-2-6-10-19/h1-15H