3-(4-fluorophenyl)-2-(2-methylpropanoyl)-5-oxidanylidene-hexanoic acid

Systemtic Name: 3-(4-fluorophenyl)-2-(2-methylpropanoyl)-5-oxidanylidene-hexanoic acid Openeye Name: 3-(4-fluorophenyl)-2-(2-methylpropanoyl)-5-oxo-hexanoic acid CAS Name: 3-(4-fluorophenyl)-2-(2-methyl-1-oxopropyl)-5-oxohexanoic acid IUPAC Name: 3-(4-fluorophenyl)-2-(2-methylpropanoyl)-5-oxohexanoic acid Traditional Name: 3-(4-fluorophenyl)-2-isobutyryl-5-keto-hexanoic acid Formula: C16H19FO4 MolecularWeight: 294.318063

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19FO4/c1-9(2)15(19)14(16(20)21)13(8-10(3)18)11-4-6-12(17)7-5-11/h4-7,9,13-14H,8H2,1-3H3,(H,20,21)