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

Systemtic Name: 2-[1-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]imidazol-2-yl]sulfanylethanoate Openeye Name: 2-[1-(2,2-difluoro-1,3-benzodioxol-5-yl)imidazol-2-yl]sulfanylacetate CAS Name: 2-[[1-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-imidazolyl]thio]acetate IUPAC Name: 2-[1-(2,2-difluoro-1,3-benzodioxol-5-yl)imidazol-2-yl]sulfanylacetate Traditional Name: 2-[[1-(2,2-difluoro-1,3-benzodioxol-5-yl)imidazol-2-yl]thio]acetate Formula: C12H7F2N2O4S- MolecularWeight: 313.256786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1N3C=CN=C3SCC(=O)[O-])OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1N3C=CN=C3SCC(=O)[O-])OC(O2)(F)F

InChI

InChI=1S/C12H8F2N2O4S/c13-12(14)19-8-2-1-7(5-9(8)20-12)16-4-3-15-11(16)21-6-10(17)18/h1-5H,6H2,(H,17,18)/p-1