(3-cyano-5-methoxy-phenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (3-cyano-5-methoxy-phenyl) tris(fluoranyl)methanesulfonate Openeye Name: (3-cyano-5-methoxy-phenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (3-cyano-5-methoxyphenyl) ester IUPAC Name: (3-cyano-5-methoxyphenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (3-cyano-5-methoxy-phenyl) ester Formula: C9H6F3NO4S MolecularWeight: 281.20845

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C#N)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC1=CC(=CC(=C1)C#N)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H6F3NO4S/c1-16-7-2-6(5-13)3-8(4-7)17-18(14,15)9(10,11)12/h2-4H,1H3