3-ethanoyl-2,5-bis(fluoranyl)benzenecarbonitrile

Systemtic Name: 3-ethanoyl-2,5-bis(fluoranyl)benzenecarbonitrile Openeye Name: 3-acetyl-2,5-difluoro-benzonitrile CAS Name: 3-acetyl-2,5-difluorobenzonitrile IUPAC Name: 3-acetyl-2,5-difluorobenzonitrile Traditional Name: 3-acetyl-2,5-difluoro-benzonitrile Formula: C9H5F2NO MolecularWeight: 181.138906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H5F2NO/c1-5(13)8-3-7(10)2-6(4-12)9(8)11/h2-3H,1H3