[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] quinoline-8-sulfonate

Systemtic Name: [1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] quinoline-8-sulfonate Openeye Name: (1,3-dioxobenzo[de]isoquinolin-2-yl) quinoline-8-sulfonate CAS Name: 8-quinolinesulfonic acid (1,3-dioxo-2-benzo[de]isoquinolinyl) ester IUPAC Name: (1,3-dioxobenzo[de]isoquinolin-2-yl) quinoline-8-sulfonate Traditional Name: quinoline-8-sulfonic acid (1,3-diketobenzo[de]isoquinolin-2-yl) ester Formula: C21H12N2O5S MolecularWeight: 404.39538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)OS(=O)(=O)C4=CC=CC5=C4N=CC=C5

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)OS(=O)(=O)C4=CC=CC5=C4N=CC=C5

InChI

InChI=1S/C21H12N2O5S/c24-20-15-9-1-5-13-6-2-10-16(18(13)15)21(25)23(20)28-29(26,27)17-11-3-7-14-8-4-12-22-19(14)17/h1-12H