2-[7-(dioxidanylsulfanyl)quinolin-2-yl]-1,3-bis(oxidanylidene)indene-5-sulfonic acid

Systemtic Name: 2-[7-(dioxidanylsulfanyl)quinolin-2-yl]-1,3-bis(oxidanylidene)indene-5-sulfonic acid Openeye Name: 2-(7-hydroperoxysulfanyl-2-quinolyl)-1,3-dioxo-indane-5-sulfonic acid CAS Name: 2-[7-(hydroperoxythio)-2-quinolinyl]-1,3-dioxo-5-indenesulfonic acid IUPAC Name: 2-(7-hydroperoxysulfanylquinolin-2-yl)-1,3-dioxoindene-5-sulfonic acid Traditional Name: 2-[7-(hydroperoxythio)-2-quinolyl]-1,3-diketo-indane-5-sulfonic acid Formula: C18H11NO7S2 MolecularWeight: 417.41244

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C1C=CC(=N2)C3C(=O)C4=C(C3=O)C=C(C=C4)S(=O)(=O)O)SOO

Isomeric SMILES

C1=CC(=CC2=C1C=CC(=N2)C3C(=O)C4=C(C3=O)C=C(C=C4)S(=O)(=O)O)SOO

InChI

InChI=1S/C18H11NO7S2/c20-17-12-5-4-11(28(23,24)25)8-13(12)18(21)16(17)14-6-2-9-1-3-10(27-26-22)7-15(9)19-14/h1-8,16,22H,(H,23,24,25)