[5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-fluoranylbenzenesulfonate

Systemtic Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-fluoranylbenzenesulfonate Openeye Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [5-ethyl-2-(4-nitrophenyl)-3-pyrazolyl] ester IUPAC Name: [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [5-ethyl-2-(4-nitrophenyl)pyrazol-3-yl] ester Formula: C17H14FN3O5S MolecularWeight: 391.373563

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14FN3O5S/c1-2-13-11-17(26-27(24,25)16-9-3-12(18)4-10-16)20(19-13)14-5-7-15(8-6-14)21(22)23/h3-11H,2H2,1H3