2-[2,6-bis(fluoranyl)phenyl]carbonylbutanenitrile

Systemtic Name: 2-[2,6-bis(fluoranyl)phenyl]carbonylbutanenitrile Openeye Name: 2-(2,6-difluorobenzoyl)butanenitrile CAS Name: 2-[(2,6-difluorophenyl)-oxomethyl]butanenitrile IUPAC Name: 2-(2,6-difluorobenzoyl)butanenitrile Traditional Name: 2-(2,6-difluorobenzoyl)butyronitrile Formula: C11H9F2NO MolecularWeight: 209.192066

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C(=O)C1=C(C=CC=C1F)F

Isomeric SMILES

CCC(C#N)C(=O)C1=C(C=CC=C1F)F

InChI

InChI=1S/C11H9F2NO/c1-2-7(6-14)11(15)10-8(12)4-3-5-9(10)13/h3-5,7H,2H2,1H3