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

Systemtic Name: 2-(2-methyl-4-oxidanyl-phenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-hydroxy-2-methyl-phenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-hydroxy-2-methylphenyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-hydroxy-2-methylphenyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-hydroxy-2-methyl-phenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C19H11N3O7 MolecularWeight: 393.30654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)O)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H11N3O7/c1-9-4-13(23)2-3-16(9)20-18(24)14-7-11(21(26)27)5-10-6-12(22(28)29)8-15(17(10)14)19(20)25/h2-8,23H,1H3