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

Systemtic Name: [6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] 2-oxidanylidene-1,3-dihydrobenzimidazole-5-sulfonate Openeye Name: (6-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl) 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate CAS Name: 2-oxo-1,3-dihydrobenzimidazole-5-sulfonic acid (6-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl) ester IUPAC Name: (6-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl) 2-oxo-1,3-dihydrobenzimidazole-5-sulfonate Traditional Name: 2-keto-1,3-dihydrobenzimidazole-5-sulfonic acid (1,3-diketo-6-nitro-benzo[de]isoquinolin-2-yl) ester Formula: C19H10N4O8S MolecularWeight: 454.3697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)OS(=O)(=O)C4=CC5=C(C=C4)NC(=O)N5)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=CC3=C2C(=C1)C(=O)N(C3=O)OS(=O)(=O)C4=CC5=C(C=C4)NC(=O)N5)[N+](=O)[O-]

InChI

InChI=1S/C19H10N4O8S/c24-17-11-3-1-2-10-15(23(27)28)7-5-12(16(10)11)18(25)22(17)31-32(29,30)9-4-6-13-14(8-9)21-19(26)20-13/h1-8H,(H2,20,21,26)