2-[2,3,6-tris(fluoranyl)phenyl]ethanoate

Systemtic Name: 2-[2,3,6-tris(fluoranyl)phenyl]ethanoate Openeye Name: 2-(2,3,6-trifluorophenyl)acetate CAS Name: 2-(2,3,6-trifluorophenyl)acetate IUPAC Name: 2-(2,3,6-trifluorophenyl)acetate Traditional Name: 2-(2,3,6-trifluorophenyl)acetate Formula: C8H4F3O2- MolecularWeight: 189.11137

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1F)CC(=O)[O-])F)F

Isomeric SMILES

C1=CC(=C(C(=C1F)CC(=O)[O-])F)F

InChI

InChI=1S/C8H5F3O2/c9-5-1-2-6(10)8(11)4(5)3-7(12)13/h1-2H,3H2,(H,12,13)/p-1