2-nitro-4-[(3-nitro-4-oxidanyl-phenyl)amino]phenol

Systemtic Name: 2-nitro-4-[(3-nitro-4-oxidanyl-phenyl)amino]phenol Openeye Name: 4-(4-hydroxy-3-nitro-anilino)-2-nitro-phenol CAS Name: 4-(4-hydroxy-3-nitroanilino)-2-nitrophenol IUPAC Name: 4-(4-hydroxy-3-nitroanilino)-2-nitrophenol Traditional Name: 4-(4-hydroxy-3-nitro-anilino)-2-nitro-phenol Formula: C12H9N3O6 MolecularWeight: 291.21636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=CC(=C(C=C2)O)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=C(C=C1NC2=CC(=C(C=C2)O)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C12H9N3O6/c16-11-3-1-7(5-9(11)14(18)19)13-8-2-4-12(17)10(6-8)15(20)21/h1-6,13,16-17H