3-bromanyl-N-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzamide

Systemtic Name: 3-bromanyl-N-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]benzamide Openeye Name: 3-bromo-N-(5,8-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)benzamide CAS Name: 3-bromo-N-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)benzamide IUPAC Name: 3-bromo-N-(5,8-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)benzamide Traditional Name: 3-bromo-N-(1,3-diketo-5,8-dinitro-benzo[de]isoquinolin-2-yl)benzamide Formula: C19H9BrN4O7 MolecularWeight: 485.20136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)NN2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)NN2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H9BrN4O7/c20-11-3-1-2-9(4-11)17(25)21-22-18(26)14-7-12(23(28)29)5-10-6-13(24(30)31)8-15(16(10)14)19(22)27/h1-8H,(H,21,25)