2-(4-ethanoylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-ethanoylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-acetylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-acetylphenyl)-5-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-acetylphenyl)-5-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-acetylphenyl)-5-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C20H12N2O5 MolecularWeight: 360.31968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-]

InChI

InChI=1S/C20H12N2O5/c1-11(23)12-5-7-14(8-6-12)21-19(24)16-4-2-3-13-9-15(22(26)27)10-17(18(13)16)20(21)25/h2-10H,1H3