[2-[2,5-bis(chloranyl)phenyl]-5-methyl-pyrazol-3-yl] 4-fluoranyl-3-methyl-benzenesulfonate

Systemtic Name: [2-[2,5-bis(chloranyl)phenyl]-5-methyl-pyrazol-3-yl] 4-fluoranyl-3-methyl-benzenesulfonate Openeye Name: [2-(2,5-dichlorophenyl)-5-methyl-pyrazol-3-yl] 4-fluoro-3-methyl-benzenesulfonate CAS Name: 4-fluoro-3-methylbenzenesulfonic acid [2-(2,5-dichlorophenyl)-5-methyl-3-pyrazolyl] ester IUPAC Name: [2-(2,5-dichlorophenyl)-5-methylpyrazol-3-yl] 4-fluoro-3-methylbenzenesulfonate Traditional Name: 4-fluoro-3-methyl-benzenesulfonic acid [2-(2,5-dichlorophenyl)-5-methyl-pyrazol-3-yl] ester Formula: C17H13Cl2FN2O3S MolecularWeight: 415.266123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)OC2=CC(=NN2C3=C(C=CC(=C3)Cl)Cl)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)OC2=CC(=NN2C3=C(C=CC(=C3)Cl)Cl)C)F

InChI

InChI=1S/C17H13Cl2FN2O3S/c1-10-7-13(4-6-15(10)20)26(23,24)25-17-8-11(2)21-22(17)16-9-12(18)3-5-14(16)19/h3-9H,1-2H3