sodium 6-oxidanidylperoxysulfanyl-2-[tris(bromanyl)methylsulfonyl]quinoline

Systemtic Name: sodium 6-oxidanidylperoxysulfanyl-2-[tris(bromanyl)methylsulfonyl]quinoline Openeye Name: sodium 6-oxidoperoxysulfanyl-2-(tribromomethylsulfonyl)quinoline CAS Name: sodium 2-(tribromomethylsulfonyl)-6-quinolinesulfenic acid oxidooxy ester IUPAC Name: sodium 6-oxidoperoxysulfanyl-2-(tribromomethylsulfonyl)quinoline Traditional Name: sodium 6-(oxidoperoxythio)-2-(tribromomethylsulfonyl)quinoline Formula: C10H5Br3NNaO5S2 MolecularWeight: 545.98217

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=N2)S(=O)(=O)C(Br)(Br)Br)C=C1SOO[O-].[Na+]

Isomeric SMILES

C1=CC2=C(C=CC(=N2)S(=O)(=O)C(Br)(Br)Br)C=C1SOO[O-].[Na+]

InChI

InChI=1S/C10H6Br3NO5S2.Na/c11-10(12,13)21(16,17)9-4-1-6-5-7(20-19-18-15)2-3-8(6)14-9;/h1-5,15H;/q;+1/p-1