4-chloranyl-4,4-dinitro-butanoic acid

Systemtic Name: 4-chloranyl-4,4-dinitro-butanoic acid Openeye Name: 4-chloro-4,4-dinitro-butanoic acid CAS Name: 4-chloro-4,4-dinitrobutanoic acid IUPAC Name: 4-chloro-4,4-dinitrobutanoic acid Traditional Name: 4-chloro-4,4-dinitro-butyric acid Formula: C4H5ClN2O6 MolecularWeight: 212.5453

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H5ClN2O6/c5-4(6(10)11,7(12)13)2-1-3(8)9/h1-2H2,(H,8,9)