6-(2,2-dimethylpropanoylamino)-2,3-bis(fluoranyl)benzoic acid

Systemtic Name: 6-(2,2-dimethylpropanoylamino)-2,3-bis(fluoranyl)benzoic acid Openeye Name: 6-(2,2-dimethylpropanoylamino)-2,3-difluoro-benzoic acid CAS Name: 6-[(2,2-dimethyl-1-oxopropyl)amino]-2,3-difluorobenzoic acid IUPAC Name: 6-(2,2-dimethylpropanoylamino)-2,3-difluorobenzoic acid Traditional Name: 2,3-difluoro-6-(pivaloylamino)benzoic acid Formula: C12H13F2NO3 MolecularWeight: 257.233326

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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)