[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] 6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate

Systemtic Name: [1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] 6-methyl-2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate Openeye Name: (1,3-dioxobenzo[de]isoquinolin-2-yl) 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate CAS Name: 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonic acid (1,3-dioxo-2-benzo[de]isoquinolinyl) ester IUPAC Name: (1,3-dioxobenzo[de]isoquinolin-2-yl) 6-methyl-2-oxo-1,3-dihydrobenzimidazole-5-sulfonate Traditional Name: 2-keto-6-methyl-1,3-dihydrobenzimidazole-5-sulfonic acid (1,3-diketobenzo[de]isoquinolin-2-yl) ester Formula: C20H13N3O6S MolecularWeight: 423.39872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1S(=O)(=O)ON3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)NC(=O)N2

Isomeric SMILES

CC1=CC2=C(C=C1S(=O)(=O)ON3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)NC(=O)N2

InChI

InChI=1S/C20H13N3O6S/c1-10-8-14-15(22-20(26)21-14)9-16(10)30(27,28)29-23-18(24)12-6-2-4-11-5-3-7-13(17(11)12)19(23)25/h2-9H,1H3,(H2,21,22,26)