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

Systemtic Name: N-[5,8-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-2-phenyl-ethanamide Openeye Name: N-(5,8-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)-2-phenyl-acetamide CAS Name: N-(5,8-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-2-phenylacetamide IUPAC Name: N-(5,8-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)-2-phenylacetamide Traditional Name: N-(1,3-diketo-5,8-dinitro-benzo[de]isoquinolin-2-yl)-2-phenyl-acetamide Formula: C20H12N4O7 MolecularWeight: 420.33188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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