4-(2,6-dimethylphenoxy)-3-fluoranyl-benzoate

Systemtic Name: 4-(2,6-dimethylphenoxy)-3-fluoranyl-benzoate Openeye Name: 4-(2,6-dimethylphenoxy)-3-fluoro-benzoate CAS Name: 4-(2,6-dimethylphenoxy)-3-fluorobenzoate IUPAC Name: 4-(2,6-dimethylphenoxy)-3-fluorobenzoate Traditional Name: 4-(2,6-dimethylphenoxy)-3-fluoro-benzoate Formula: C15H12FO3- MolecularWeight: 259.252383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=C(C=C(C=C2)C(=O)[O-])F

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=C(C=C(C=C2)C(=O)[O-])F

InChI

InChI=1S/C15H13FO3/c1-9-4-3-5-10(2)14(9)19-13-7-6-11(15(17)18)8-12(13)16/h3-8H,1-2H3,(H,17,18)/p-1