[2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] 4-fluoranylbenzenesulfonate

Systemtic Name: [2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] 4-fluoranylbenzenesulfonate Openeye Name: [2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [2-(3,4-dichlorophenyl)-5-phenyl-3-pyrazolyl] ester IUPAC Name: [2-(3,4-dichlorophenyl)-5-phenylpyrazol-3-yl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [2-(3,4-dichlorophenyl)-5-phenyl-pyrazol-3-yl] ester Formula: C21H13Cl2FN2O3S MolecularWeight: 463.308923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H13Cl2FN2O3S/c22-18-11-8-16(12-19(18)23)26-21(13-20(25-26)14-4-2-1-3-5-14)29-30(27,28)17-9-6-15(24)7-10-17/h1-13H