2-(4-fluoranyl-3-methyl-phenyl)carbonyl-3,3-dimethyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 2-(4-fluoranyl-3-methyl-phenyl)carbonyl-3,3-dimethyl-5-oxidanylidene-hexanoic acid Openeye Name: 2-(4-fluoro-3-methyl-benzoyl)-3,3-dimethyl-5-oxo-hexanoic acid CAS Name: 2-[(4-fluoro-3-methylphenyl)-oxomethyl]-3,3-dimethyl-5-oxohexanoic acid IUPAC Name: 2-(4-fluoro-3-methylbenzoyl)-3,3-dimethyl-5-oxohexanoic acid Traditional Name: 2-(4-fluoro-3-methyl-benzoyl)-5-keto-3,3-dimethyl-hexanoic acid Formula: C16H19FO4 MolecularWeight: 294.318063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C(C(=O)O)C(C)(C)CC(=O)C)F

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C(C(=O)O)C(C)(C)CC(=O)C)F

InChI

InChI=1S/C16H19FO4/c1-9-7-11(5-6-12(9)17)14(19)13(15(20)21)16(3,4)8-10(2)18/h5-7,13H,8H2,1-4H3,(H,20,21)