[(E)-2-cyano-3-methylperoxy-prop-1-enyl] ethanoate

Systemtic Name: [(E)-2-cyano-3-methylperoxy-prop-1-enyl] ethanoate Openeye Name: [(E)-2-cyano-3-methylperoxy-prop-1-enyl] acetate CAS Name: acetic acid [(E)-2-cyano-3-methyldioxyprop-1-enyl] ester IUPAC Name: [(E)-2-cyano-3-methylperoxyprop-1-enyl] acetate Traditional Name: acetic acid [(E)-2-cyano-3-methylperoxy-prop-1-enyl] ester Formula: C7H9NO4 MolecularWeight: 171.15066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC=C(COOC)C#N

Isomeric SMILES

CC(=O)O/C=C(/COOC)\C#N

InChI

InChI=1S/C7H9NO4/c1-6(9)11-4-7(3-8)5-12-10-2/h4H,5H2,1-2H3/b7-4+