4-(2-chloranyl-5-fluoranyl-phenyl)-4-methyl-2-oxidanylidene-pentanoic acid

Systemtic Name: 4-(2-chloranyl-5-fluoranyl-phenyl)-4-methyl-2-oxidanylidene-pentanoic acid Openeye Name: 4-(2-chloro-5-fluoro-phenyl)-4-methyl-2-oxo-pentanoic acid CAS Name: 4-(2-chloro-5-fluorophenyl)-4-methyl-2-oxopentanoic acid IUPAC Name: 4-(2-chloro-5-fluorophenyl)-4-methyl-2-oxopentanoic acid Traditional Name: 4-(2-chloro-5-fluoro-phenyl)-2-keto-4-methyl-valeric acid Formula: C12H12ClFO3 MolecularWeight: 258.673283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClFO3/c1-12(2,6-10(15)11(16)17)8-5-7(14)3-4-9(8)13/h3-5H,6H2,1-2H3,(H,16,17)