2-[5-fluoranyl-4-(2-methylpropyl)-2-oxidanylidene-cyclohex-3-en-1-yl]propanoic acid

Systemtic Name: 2-[5-fluoranyl-4-(2-methylpropyl)-2-oxidanylidene-cyclohex-3-en-1-yl]propanoic acid Openeye Name: 2-(5-fluoro-4-isobutyl-2-oxo-cyclohex-3-en-1-yl)propanoic acid CAS Name: 2-[5-fluoro-4-(2-methylpropyl)-2-oxo-1-cyclohex-3-enyl]propanoic acid IUPAC Name: 2-[5-fluoro-4-(2-methylpropyl)-2-oxocyclohex-3-en-1-yl]propanoic acid Traditional Name: 2-(5-fluoro-4-isobutyl-2-keto-cyclohex-3-en-1-yl)propionic acid Formula: C13H19FO3 MolecularWeight: 242.286563

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=O)C(CC1F)C(C)C(=O)O

Isomeric SMILES

CC(C)CC1=CC(=O)C(CC1F)C(C)C(=O)O

InChI

InChI=1S/C13H19FO3/c1-7(2)4-9-5-12(15)10(6-11(9)14)8(3)13(16)17/h5,7-8,10-11H,4,6H2,1-3H3,(H,16,17)