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The molecular formula is C17H20FNO2.
It was created on December 5, 2007, and last modified on December 30, 2023.
The IUPAC name is "(4-cyano-3-fluorophenyl) 4-propylcyclohexane-1-carboxylate."
The InChI is InChI=1S/C17H20FNO2/c1-2-3-12-4-6-13(7-5-12)17(20)21-15-9-8-14(11-19)16(18)10-15/h8-10,12-13H,2-7H2,1H3.
The InChIKey is FVNRZUYRHIAXDA-UHFFFAOYSA-N.
The Canonical SMILES is CCCC1CCC(CC1)C(=O)OC2=CC(=C(C=C2)C#N)F.
The molecular weight is 289.34 g/mol.
The compound has 4 hydrogen bond acceptor counts.
The XLogP3-AA value is 4.9.
Yes, the compound is canonicalized according to PubChem.
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