4-[2,6-bis(fluoranyl)phenyl]-4-methyl-2-oxidanylidene-hexanoic acid

Systemtic Name: 4-[2,6-bis(fluoranyl)phenyl]-4-methyl-2-oxidanylidene-hexanoic acid Openeye Name: 4-(2,6-difluorophenyl)-4-methyl-2-oxo-hexanoic acid CAS Name: 4-(2,6-difluorophenyl)-4-methyl-2-oxohexanoic acid IUPAC Name: 4-(2,6-difluorophenyl)-4-methyl-2-oxohexanoic acid Traditional Name: 4-(2,6-difluorophenyl)-2-keto-4-methyl-hexanoic acid Formula: C13H14F2O3 MolecularWeight: 256.245266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(=O)C(=O)O)C1=C(C=CC=C1F)F

Isomeric SMILES

CCC(C)(CC(=O)C(=O)O)C1=C(C=CC=C1F)F

InChI

InChI=1S/C13H14F2O3/c1-3-13(2,7-10(16)12(17)18)11-8(14)5-4-6-9(11)15/h4-6H,3,7H2,1-2H3,(H,17,18)