2-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]ethanenitrile

Systemtic Name: 2-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]ethanenitrile Openeye Name: 2-(2,2-difluoro-1,3-benzodioxol-5-yl)acetonitrile CAS Name: 2-(2,2-difluoro-1,3-benzodioxol-5-yl)acetonitrile IUPAC Name: 2-(2,2-difluoro-1,3-benzodioxol-5-yl)acetonitrile Traditional Name: 2-(2,2-difluoro-1,3-benzodioxol-5-yl)acetonitrile Formula: C9H5F2NO2 MolecularWeight: 197.138306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CC#N)OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1CC#N)OC(O2)(F)F

InChI

InChI=1S/C9H5F2NO2/c10-9(11)13-7-2-1-6(3-4-12)5-8(7)14-9/h1-2,5H,3H2