(3S)-5-[3,5-bis(fluoranyl)phenyl]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3S)-5-[3,5-bis(fluoranyl)phenyl]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3S)-5-(3,5-difluorophenyl)-3-methyl-5-oxo-pentanoate CAS Name: (3S)-5-(3,5-difluorophenyl)-3-methyl-5-oxopentanoate IUPAC Name: (3S)-5-(3,5-difluorophenyl)-3-methyl-5-oxopentanoate Traditional Name: (3S)-5-(3,5-difluorophenyl)-5-keto-3-methyl-valerate Formula: C12H11F2O3- MolecularWeight: 241.210746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC(=CC(=C1)F)F)CC(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C12H12F2O3/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)/p-1/t7-/m0/s1