4-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-1-oxidanyl-pyrrole-3-carbonitrile

Systemtic Name: 4-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-1-oxidanyl-pyrrole-3-carbonitrile Openeye Name: 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1-hydroxy-pyrrole-3-carbonitrile CAS Name: 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1-hydroxy-3-pyrrolecarbonitrile IUPAC Name: 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1-hydroxypyrrole-3-carbonitrile Traditional Name: 4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1-hydroxy-pyrrole-3-carbonitrile Formula: C12H6F2N2O3 MolecularWeight: 264.184446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)OC(O2)(F)F)C3=CN(C=C3C#N)O

Isomeric SMILES

C1=CC(=C2C(=C1)OC(O2)(F)F)C3=CN(C=C3C#N)O

InChI

InChI=1S/C12H6F2N2O3/c13-12(14)18-10-3-1-2-8(11(10)19-12)9-6-16(17)5-7(9)4-15/h1-3,5-6,17H