ethyl 2,2-dinitrobutanoate

Systemtic Name: ethyl 2,2-dinitrobutanoate Openeye Name: ethyl 2,2-dinitrobutanoate CAS Name: 2,2-dinitrobutanoic acid ethyl ester IUPAC Name: ethyl 2,2-dinitrobutanoate Traditional Name: 2,2-dinitrobutyric acid ethyl ester Formula: C6H10N2O6 MolecularWeight: 206.1534

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)OCC)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H10N2O6/c1-3-6(7(10)11,8(12)13)5(9)14-4-2/h3-4H2,1-2H3