2-nitro-2-(3-nitro-5-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-nitro-2-(3-nitro-5-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(3-hydroxy-5-nitro-phenyl)-2-nitro-acetic acid CAS Name: 2-(3-hydroxy-5-nitrophenyl)-2-nitroacetic acid IUPAC Name: 2-(3-hydroxy-5-nitrophenyl)-2-nitroacetic acid Traditional Name: 2-(3-hydroxy-5-nitro-phenyl)-2-nitro-acetic acid Formula: C8H6N2O7 MolecularWeight: 242.14244

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1[N+](=O)[O-])O)C(C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C=C1[N+](=O)[O-])O)C(C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H6N2O7/c11-6-2-4(1-5(3-6)9(14)15)7(8(12)13)10(16)17/h1-3,7,11H,(H,12,13)