(2E)-5-nitro-2-[oxidanyl(phenyl)methylidene]-1H-pyridine-3,4-dione hydrobromide

Systemtic Name: (2E)-5-nitro-2-[oxidanyl(phenyl)methylidene]-1H-pyridine-3,4-dione hydrobromide Openeye Name: (2E)-2-[hydroxy(phenyl)methylene]-5-nitro-1H-pyridine-3,4-dione hydrobromide CAS Name: (2E)-2-[hydroxy(phenyl)methylidene]-5-nitro-1H-pyridine-3,4-dione hydrobromide IUPAC Name: (2E)-2-[hydroxy(phenyl)methylidene]-5-nitro-1H-pyridine-3,4-dione hydrobromide Traditional Name: (2E)-2-[hydroxy(phenyl)methylene]-5-nitro-1H-pyridine-3,4-quinone hydrobromide Formula: C12H9BrN2O5 MolecularWeight: 341.11426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C(=O)C(=O)C(=CN2)[N+](=O)[O-])O.Br

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\2/C(=O)C(=O)C(=CN2)[N+](=O)[O-])/O.Br

InChI

InChI=1S/C12H8N2O5.BrH/c15-10(7-4-2-1-3-5-7)9-12(17)11(16)8(6-13-9)14(18)19;/h1-6,13,15H;1H/b10-9+;