2-(3,5-dinitro-2-oxidanyl-phenyl)ethanoic acid

Systemtic Name: 2-(3,5-dinitro-2-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-(2-hydroxy-3,5-dinitro-phenyl)acetic acid CAS Name: 2-(2-hydroxy-3,5-dinitrophenyl)acetic acid IUPAC Name: 2-(2-hydroxy-3,5-dinitrophenyl)acetic acid Traditional Name: 2-(2-hydroxy-3,5-dinitro-phenyl)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)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C8H6N2O7/c11-7(12)2-4-1-5(9(14)15)3-6(8(4)13)10(16)17/h1,3,13H,2H2,(H,11,12)