(3,3-dimethyl-2-oxidanylidene-butyl) 2-chloranyl-4,5-bis(fluoranyl)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-chloranyl-4,5-bis(fluoranyl)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-chloro-4,5-difluoro-benzoate CAS Name: 2-chloro-4,5-difluorobenzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-chloro-4,5-difluorobenzoate Traditional Name: 2-chloro-4,5-difluoro-benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C13H13ClF2O3 MolecularWeight: 290.690326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC(=C(C=C1Cl)F)F

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC(=C(C=C1Cl)F)F

InChI

InChI=1S/C13H13ClF2O3/c1-13(2,3)11(17)6-19-12(18)7-4-9(15)10(16)5-8(7)14/h4-5H,6H2,1-3H3