1-[6,7-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-chloranyl-5-methyl-pyridin-1-ium

Systemtic Name: 1-[6,7-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-chloranyl-5-methyl-pyridin-1-ium Openeye Name: 2-chloro-1-(6,7-difluoro-1,3-benzodioxol-5-yl)-5-methyl-pyridin-1-ium CAS Name: 2-chloro-1-(6,7-difluoro-1,3-benzodioxol-5-yl)-5-methylpyridin-1-ium IUPAC Name: 2-chloro-1-(6,7-difluoro-1,3-benzodioxol-5-yl)-5-methylpyridin-1-ium Traditional Name: 2-chloro-1-(6,7-difluoro-1,3-benzodioxol-5-yl)-5-methyl-pyridin-1-ium Formula: C13H9ClF2NO2+ MolecularWeight: 284.665866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=C(C=C1)Cl)C2=CC3=C(C(=C2F)F)OCO3

Isomeric SMILES

CC1=C[N+](=C(C=C1)Cl)C2=CC3=C(C(=C2F)F)OCO3

InChI

InChI=1S/C13H9ClF2NO2/c1-7-2-3-10(14)17(5-7)8-4-9-13(19-6-18-9)12(16)11(8)15/h2-5H,6H2,1H3/q+1