2,2,3,3-tetrakis(fluoranyl)propyl 4-(5-ethyl-1-phenyl-pyrazol-3-yl)benzenesulfonate

Systemtic Name: 2,2,3,3-tetrakis(fluoranyl)propyl 4-(5-ethyl-1-phenyl-pyrazol-3-yl)benzenesulfonate Openeye Name: 2,2,3,3-tetrafluoropropyl 4-(5-ethyl-1-phenyl-pyrazol-3-yl)benzenesulfonate CAS Name: 4-(5-ethyl-1-phenyl-3-pyrazolyl)benzenesulfonic acid 2,2,3,3-tetrafluoropropyl ester IUPAC Name: 2,2,3,3-tetrafluoropropyl 4-(5-ethyl-1-phenylpyrazol-3-yl)benzenesulfonate Traditional Name: 4-(5-ethyl-1-phenyl-pyrazol-3-yl)benzenesulfonic acid 2,2,3,3-tetrafluoropropyl ester Formula: C20H18F4N2O3S MolecularWeight: 442.427133

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)OCC(C(F)F)(F)F

Isomeric SMILES

CCC1=CC(=NN1C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)OCC(C(F)F)(F)F

InChI

InChI=1S/C20H18F4N2O3S/c1-2-15-12-18(25-26(15)16-6-4-3-5-7-16)14-8-10-17(11-9-14)30(27,28)29-13-20(23,24)19(21)22/h3-12,19H,2,13H2,1H3