3,5-dimethyl-4-[2,2,2-tris(fluoranyl)ethoxy]benzoate

Systemtic Name: 3,5-dimethyl-4-[2,2,2-tris(fluoranyl)ethoxy]benzoate Openeye Name: 3,5-dimethyl-4-(2,2,2-trifluoroethoxy)benzoate CAS Name: 3,5-dimethyl-4-(2,2,2-trifluoroethoxy)benzoate IUPAC Name: 3,5-dimethyl-4-(2,2,2-trifluoroethoxy)benzoate Traditional Name: 3,5-dimethyl-4-(2,2,2-trifluoroethoxy)benzoate Formula: C11H10F3O3- MolecularWeight: 247.19051

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(F)(F)F)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(F)(F)F)C)C(=O)[O-]

InChI

InChI=1S/C11H11F3O3/c1-6-3-8(10(15)16)4-7(2)9(6)17-5-11(12,13)14/h3-4H,5H2,1-2H3,(H,15,16)/p-1