[2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 2-chloranyl-4-(trifluoromethyl)benzenesulfonate

Systemtic Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 2-chloranyl-4-(trifluoromethyl)benzenesulfonate Openeye Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 2-chloro-4-(trifluoromethyl)benzenesulfonate CAS Name: 2-chloro-4-(trifluoromethyl)benzenesulfonic acid [2-methyl-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] 2-chloro-4-(trifluoromethyl)benzenesulfonate Traditional Name: 2-chloro-4-(trifluoromethyl)benzenesulfonic acid [2-methyl-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C12H7ClF6N2O3S MolecularWeight: 408.703999

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=N1)C(F)(F)F)OS(=O)(=O)C2=C(C=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

CN1C(=CC(=N1)C(F)(F)F)OS(=O)(=O)C2=C(C=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C12H7ClF6N2O3S/c1-21-10(5-9(20-21)12(17,18)19)24-25(22,23)8-3-2-6(4-7(8)13)11(14,15)16/h2-5H,1H3