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

Systemtic Name: 2-(4-methoxy-2-nitro-phenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione Openeye Name: 2-(4-methoxy-2-nitro-phenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-dione CAS Name: 2-(4-methoxy-2-nitrophenyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione IUPAC Name: 2-(4-methoxy-2-nitrophenyl)-5,8-dinitrobenzo[de]isoquinoline-1,3-dione Traditional Name: 2-(4-methoxy-2-nitro-phenyl)-5,8-dinitro-benzo[de]isoquinoline-1,3-quinone Formula: C19H10N4O9 MolecularWeight: 438.3041

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)N2C(=O)C3=CC(=CC4=CC(=CC(=C43)C2=O)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H10N4O9/c1-32-12-2-3-15(16(8-12)23(30)31)20-18(24)13-6-10(21(26)27)4-9-5-11(22(28)29)7-14(17(9)13)19(20)25/h2-8H,1H3