4,4-dinitrobutanoic acid

Systemtic Name: 4,4-dinitrobutanoic acid Openeye Name: 4,4-dinitrobutanoic acid CAS Name: 4,4-dinitrobutanoic acid IUPAC Name: 4,4-dinitrobutanoic acid Traditional Name: 4,4-dinitrobutyric acid Formula: C4H6N2O6 MolecularWeight: 178.10024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H6N2O6/c7-4(8)2-1-3(5(9)10)6(11)12/h3H,1-2H2,(H,7,8)