2-[3,3-bis(fluoranyl)-2H-1,4-benzodioxin-6-yl]butanenitrile

Systemtic Name: 2-[3,3-bis(fluoranyl)-2H-1,4-benzodioxin-6-yl]butanenitrile Openeye Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)butanenitrile CAS Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)butanenitrile IUPAC Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)butanenitrile Traditional Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)butyronitrile Formula: C12H11F2NO2 MolecularWeight: 239.218046

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)C1=CC2=C(C=C1)OCC(O2)(F)F

Isomeric SMILES

CCC(C#N)C1=CC2=C(C=C1)OCC(O2)(F)F

InChI

InChI=1S/C12H11F2NO2/c1-2-8(6-15)9-3-4-10-11(5-9)17-12(13,14)7-16-10/h3-5,8H,2,7H2,1H3