(2-bromanyl-4-fluoranyl-phenyl) 3,5-dimethyl-1H-pyrazole-4-sulfonate

Systemtic Name: (2-bromanyl-4-fluoranyl-phenyl) 3,5-dimethyl-1H-pyrazole-4-sulfonate Openeye Name: (2-bromo-4-fluoro-phenyl) 3,5-dimethyl-1H-pyrazole-4-sulfonate CAS Name: 3,5-dimethyl-1H-pyrazole-4-sulfonic acid (2-bromo-4-fluorophenyl) ester IUPAC Name: (2-bromo-4-fluorophenyl) 3,5-dimethyl-1H-pyrazole-4-sulfonate Traditional Name: 3,5-dimethyl-1H-pyrazole-4-sulfonic acid (2-bromo-4-fluoro-phenyl) ester Formula: C11H10BrFN2O3S MolecularWeight: 349.176103

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)S(=O)(=O)OC2=C(C=C(C=C2)F)Br

Isomeric SMILES

CC1=C(C(=NN1)C)S(=O)(=O)OC2=C(C=C(C=C2)F)Br

InChI

InChI=1S/C11H10BrFN2O3S/c1-6-11(7(2)15-14-6)19(16,17)18-10-4-3-8(13)5-9(10)12/h3-5H,1-2H3,(H,14,15)