2-(4-ethanoylphenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(4-ethanoylphenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-acetylphenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-acetylphenyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-acetylphenyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-acetylphenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C20H11N3O7 MolecularWeight: 405.31724

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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-])[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-])[N+](=O)[O-]

InChI

InChI=1S/C20H11N3O7/c1-10(24)11-2-4-13(5-3-11)21-19(25)16-8-14(22(27)28)6-12-7-15(23(29)30)9-17(18(12)16)20(21)26/h2-9H,1H3