[4-(3-fluoranyl-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(3-fluoranyl-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [4-(3-fluoro-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-(3-fluoro-4-methylsulfonyloxyphenyl)-2,5-dimethoxyphenyl] ester IUPAC Name: [4-(3-fluoro-4-methylsulfonyloxyphenyl)-2,5-dimethoxyphenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(3-fluoro-4-methylsulfonyloxy-phenyl)-2,5-dimethoxy-phenyl] ester Formula: C16H14F4O8S2 MolecularWeight: 474.401173

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC(=C(C=C2)OS(=O)(=O)C)F)OC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC(=C(C=C2)OS(=O)(=O)C)F)OC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C16H14F4O8S2/c1-25-13-8-15(28-30(23,24)16(18,19)20)14(26-2)7-10(13)9-4-5-12(11(17)6-9)27-29(3,21)22/h4-8H,1-3H3