4-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-5-ethanoyl-1H-pyrrole-3-carbonitrile

Systemtic Name: 4-[2,2-bis(fluoranyl)-1,3-benzodioxol-4-yl]-5-ethanoyl-1H-pyrrole-3-carbonitrile Openeye Name: 5-acetyl-4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile CAS Name: 5-acetyl-4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile IUPAC Name: 5-acetyl-4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile Traditional Name: 5-acetyl-4-(2,2-difluoro-1,3-benzodioxol-4-yl)-1H-pyrrole-3-carbonitrile Formula: C14H8F2N2O3 MolecularWeight: 290.221726

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=CN1)C#N)C2=C3C(=CC=C2)OC(O3)(F)F

Isomeric SMILES

CC(=O)C1=C(C(=CN1)C#N)C2=C3C(=CC=C2)OC(O3)(F)F

InChI

InChI=1S/C14H8F2N2O3/c1-7(19)12-11(8(5-17)6-18-12)9-3-2-4-10-13(9)21-14(15,16)20-10/h2-4,6,18H,1H3