(3S)-5-(3-chloranyl-5-fluoranyl-phenyl)-3-methyl-5-oxidanylidene-pentanoic acid

Systemtic Name: (3S)-5-(3-chloranyl-5-fluoranyl-phenyl)-3-methyl-5-oxidanylidene-pentanoic acid Openeye Name: (3S)-5-(3-chloro-5-fluoro-phenyl)-3-methyl-5-oxo-pentanoic acid CAS Name: (3S)-5-(3-chloro-5-fluorophenyl)-3-methyl-5-oxopentanoic acid IUPAC Name: (3S)-5-(3-chloro-5-fluorophenyl)-3-methyl-5-oxopentanoic acid Traditional Name: (3S)-5-(3-chloro-5-fluoro-phenyl)-5-keto-3-methyl-valeric acid Formula: C12H12ClFO3 MolecularWeight: 258.673283

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](CC(=O)C1=CC(=CC(=C1)Cl)F)CC(=O)O

InChI

InChI=1S/C12H12ClFO3/c1-7(3-12(16)17)2-11(15)8-4-9(13)6-10(14)5-8/h4-7H,2-3H2,1H3,(H,16,17)/t7-/m0/s1