[5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] 4-methylbenzenesulfonate Openeye Name: [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [5-ethyl-2-(4-fluorophenyl)-3-pyrazolyl] ester IUPAC Name: [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [5-ethyl-2-(4-fluorophenyl)pyrazol-3-yl] ester Formula: C18H17FN2O3S MolecularWeight: 360.402583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

Isomeric SMILES

CCC1=NN(C(=C1)OS(=O)(=O)C2=CC=C(C=C2)C)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H17FN2O3S/c1-3-15-12-18(21(20-15)16-8-6-14(19)7-9-16)24-25(22,23)17-10-4-13(2)5-11-17/h4-12H,3H2,1-2H3