5-[2-[3,4-bis(fluoranyl)phenyl]ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid

Systemtic Name: 5-[2-[3,4-bis(fluoranyl)phenyl]ethyl]-6-methyl-5-oxidanyl-3-oxidanylidene-heptanoic acid Openeye Name: 5-[2-(3,4-difluorophenyl)ethyl]-5-hydroxy-6-methyl-3-oxo-heptanoic acid CAS Name: 5-[2-(3,4-difluorophenyl)ethyl]-5-hydroxy-6-methyl-3-oxoheptanoic acid IUPAC Name: 5-[2-(3,4-difluorophenyl)ethyl]-5-hydroxy-6-methyl-3-oxoheptanoic acid Traditional Name: 5-[2-(3,4-difluorophenyl)ethyl]-5-hydroxy-3-keto-6-methyl-enanthic acid Formula: C16H20F2O4 MolecularWeight: 314.324406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCC1=CC(=C(C=C1)F)F)(CC(=O)CC(=O)O)O

Isomeric SMILES

CC(C)C(CCC1=CC(=C(C=C1)F)F)(CC(=O)CC(=O)O)O

InChI

InChI=1S/C16H20F2O4/c1-10(2)16(22,9-12(19)8-15(20)21)6-5-11-3-4-13(17)14(18)7-11/h3-4,7,10,22H,5-6,8-9H2,1-2H3,(H,20,21)