(4-methoxyphenyl) 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]oxybenzenesulfonate

Systemtic Name: (4-methoxyphenyl) 4-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]oxybenzenesulfonate Openeye Name: (4-methoxyphenyl) 4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]benzenesulfonate CAS Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]benzenesulfonic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxybenzenesulfonate Traditional Name: 4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]benzenesulfonic acid (4-methoxyphenyl) ester Formula: C19H13ClF3NO5S MolecularWeight: 459.82343

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C19H13ClF3NO5S/c1-27-13-2-4-15(5-3-13)29-30(25,26)16-8-6-14(7-9-16)28-18-17(20)10-12(11-24-18)19(21,22)23/h2-11H,1H3