6-(2,2-dimethylpropanoylamino)-2,3-bis(fluoranyl)benzoate

Systemtic Name: 6-(2,2-dimethylpropanoylamino)-2,3-bis(fluoranyl)benzoate Openeye Name: 6-(2,2-dimethylpropanoylamino)-2,3-difluoro-benzoate CAS Name: 6-[(2,2-dimethyl-1-oxopropyl)amino]-2,3-difluorobenzoate IUPAC Name: 6-(2,2-dimethylpropanoylamino)-2,3-difluorobenzoate Traditional Name: 2,3-difluoro-6-(pivaloylamino)benzoate Formula: C12H12F2NO3- MolecularWeight: 256.225386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C(=C(C=C1)F)F)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C(=C(C=C1)F)F)C(=O)[O-]

InChI

InChI=1S/C12H13F2NO3/c1-12(2,3)11(18)15-7-5-4-6(13)9(14)8(7)10(16)17/h4-5H,1-3H3,(H,15,18)(H,16,17)/p-1