3-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-4-isocyano-1H-pyrrole

Systemtic Name: 3-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-4-isocyano-1H-pyrrole Openeye Name: 3-(2,2-difluoro-1,3-benzodioxol-4-yl)-4-isocyano-1H-pyrrole CAS Name: 3-(2,2-difluoro-1,3-benzodioxol-4-yl)-4-isocyano-1H-pyrrole IUPAC Name: 3-(2,2-difluoro-1,3-benzodioxol-4-yl)-4-isocyano-1H-pyrrole Traditional Name: 3-(2,2-difluoro-1,3-benzodioxol-4-yl)-4-isocyano-1H-pyrrole Formula: C12H6F2N2O2 MolecularWeight: 248.185046

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CNC=C1C2=C3C(=CC=C2)OC(O3)(F)F

Isomeric SMILES

[C-]#[N+]C1=CNC=C1C2=C3C(=CC=C2)OC(O3)(F)F

InChI

InChI=1S/C12H6F2N2O2/c1-15-9-6-16-5-8(9)7-3-2-4-10-11(7)18-12(13,14)17-10/h2-6,16H