2-(5-nitro-2-oxidanyl-phenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-(5-nitro-2-oxidanyl-phenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-(2-hydroxy-5-nitro-phenyl)-5-(3-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(2-hydroxy-5-nitrophenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(2-hydroxy-5-nitrophenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(2-hydroxy-5-nitro-phenyl)-5-(3-nitrophenoxy)isoindoline-1,3-quinone Formula: C20H11N3O8 MolecularWeight: 421.31664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=CC(=C4)[N+](=O)[O-])O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=CC(=C4)[N+](=O)[O-])O)[N+](=O)[O-]

InChI

InChI=1S/C20H11N3O8/c24-18-7-4-12(23(29)30)9-17(18)21-19(25)15-6-5-14(10-16(15)20(21)26)31-13-3-1-2-11(8-13)22(27)28/h1-10,24H