N-[6,7-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[6,7-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-2-phenyl-ethanamide Openeye Name: N-(6,7-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)-2-phenyl-acetamide CAS Name: N-(6,7-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-2-phenylacetamide IUPAC Name: N-(6,7-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)-2-phenylacetamide Traditional Name: N-(1,3-diketo-6,7-dinitro-benzo[de]isoquinolin-2-yl)-2-phenyl-acetamide Formula: C20H12N4O7 MolecularWeight: 420.33188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H12N4O7/c25-16(10-11-4-2-1-3-5-11)21-22-19(26)12-6-8-14(23(28)29)18-15(24(30)31)9-7-13(17(12)18)20(22)27/h1-9H,10H2,(H,21,25)