[2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methoxybenzenesulfonate

Systemtic Name: [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methoxybenzenesulfonate Openeye Name: [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methoxybenzenesulfonate CAS Name: 4-methoxybenzenesulfonic acid [2-phenyl-5-(trifluoromethyl)-3-pyrazolyl] ester IUPAC Name: [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] 4-methoxybenzenesulfonate Traditional Name: 4-methoxybenzenesulfonic acid [2-phenyl-5-(trifluoromethyl)pyrazol-3-yl] ester Formula: C17H13F3N2O4S MolecularWeight: 398.35633

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NN2C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)OC2=CC(=NN2C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C17H13F3N2O4S/c1-25-13-7-9-14(10-8-13)27(23,24)26-16-11-15(17(18,19)20)21-22(16)12-5-3-2-4-6-12/h2-11H,1H3