(3,3-dinitro-4-oxidanyl-butyl) ethanoate

Systemtic Name: (3,3-dinitro-4-oxidanyl-butyl) ethanoate Openeye Name: (4-hydroxy-3,3-dinitro-butyl) acetate CAS Name: acetic acid (4-hydroxy-3,3-dinitrobutyl) ester IUPAC Name: (4-hydroxy-3,3-dinitrobutyl) acetate Traditional Name: acetic acid (4-hydroxy-3,3-dinitro-butyl) ester Formula: C6H10N2O7 MolecularWeight: 222.1528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC(CO)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCC(CO)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H10N2O7/c1-5(10)15-3-2-6(4-9,7(11)12)8(13)14/h9H,2-4H2,1H3