N-[6,7-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-4-nitro-benzamide

Systemtic Name: N-[6,7-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-4-nitro-benzamide Openeye Name: N-(6,7-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)-4-nitro-benzamide CAS Name: N-(6,7-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-4-nitrobenzamide IUPAC Name: N-(6,7-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)-4-nitrobenzamide Traditional Name: N-(1,3-diketo-6,7-dinitro-benzo[de]isoquinolin-2-yl)-4-nitro-benzamide Formula: C19H9N5O9 MolecularWeight: 451.30286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NN2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NN2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O)[N+](=O)[O-]

InChI

InChI=1S/C19H9N5O9/c25-17(9-1-3-10(4-2-9)22(28)29)20-21-18(26)11-5-7-13(23(30)31)16-14(24(32)33)8-6-12(15(11)16)19(21)27/h1-8H,(H,20,25)