3-bromanyl-5-ethoxy-4-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid

Systemtic Name: 3-bromanyl-5-ethoxy-4-[2,2,2-tris(fluoranyl)ethoxy]benzoic acid Openeye Name: 3-bromo-5-ethoxy-4-(2,2,2-trifluoroethoxy)benzoic acid CAS Name: 3-bromo-5-ethoxy-4-(2,2,2-trifluoroethoxy)benzoic acid IUPAC Name: 3-bromo-5-ethoxy-4-(2,2,2-trifluoroethoxy)benzoic acid Traditional Name: 3-bromo-5-ethoxy-4-(2,2,2-trifluoroethoxy)benzoic acid Formula: C11H10BrF3O4 MolecularWeight: 343.09391

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC(F)(F)F

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Br)OCC(F)(F)F

InChI

InChI=1S/C11H10BrF3O4/c1-2-18-8-4-6(10(16)17)3-7(12)9(8)19-5-11(13,14)15/h3-4H,2,5H2,1H3,(H,16,17)