[5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] 4-bromanylnaphthalene-1-sulfonate

Systemtic Name: [5-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl] 4-bromanylnaphthalene-1-sulfonate Openeye Name: (5-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl) 4-bromonaphthalene-1-sulfonate CAS Name: 4-bromo-1-naphthalenesulfonic acid (5-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl) ester IUPAC Name: (5-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl) 4-bromonaphthalene-1-sulfonate Traditional Name: 4-bromonaphthalene-1-sulfonic acid (1,3-diketo-5-nitro-benzo[de]isoquinolin-2-yl) ester Formula: C22H11BrN2O7S MolecularWeight: 527.30094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)ON3C(=O)C4=CC=CC5=CC(=CC(=C54)C3=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2Br)S(=O)(=O)ON3C(=O)C4=CC=CC5=CC(=CC(=C54)C3=O)[N+](=O)[O-]

InChI

InChI=1S/C22H11BrN2O7S/c23-18-8-9-19(15-6-2-1-5-14(15)18)33(30,31)32-24-21(26)16-7-3-4-12-10-13(25(28)29)11-17(20(12)16)22(24)27/h1-11H