ethyl 2,2,3,3,4,4-hexanitrobutanoate

Systemtic Name: ethyl 2,2,3,3,4,4-hexanitrobutanoate Openeye Name: ethyl 2,2,3,3,4,4-hexanitrobutanoate CAS Name: 2,2,3,3,4,4-hexanitrobutanoic acid ethyl ester IUPAC Name: ethyl 2,2,3,3,4,4-hexanitrobutanoate Traditional Name: 2,2,3,3,4,4-hexanitrobutyric acid ethyl ester Formula: C6H6N6O14 MolecularWeight: 386.14364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H6N6O14/c1-2-26-4(13)6(11(22)23,12(24)25)5(9(18)19,10(20)21)3(7(14)15)8(16)17/h3H,2H2,1H3