2-(4-ethanoylphenyl)-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-ethanoylphenyl)-6-nitro-5-oxidanyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-acetylphenyl)-5-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-acetylphenyl)-5-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-acetylphenyl)-5-hydroxy-6-nitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-acetylphenyl)-5-hydroxy-6-nitro-benzo[de]isoquinoline-1,3-quinone Formula: C20H12N2O6 MolecularWeight: 376.31908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4[N+](=O)[O-])O)C2=O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2C(=O)C3=CC=CC4=C3C(=CC(=C4[N+](=O)[O-])O)C2=O

InChI

InChI=1S/C20H12N2O6/c1-10(23)11-5-7-12(8-6-11)21-19(25)14-4-2-3-13-17(14)15(20(21)26)9-16(24)18(13)22(27)28/h2-9,24H,1H3