[(1S,5S)-6-cyano-1,5-dimethyl-2-oxidanylidene-8-oxabicyclo[3.2.1]oct-3-en-6-yl] ethanoate

Systemtic Name: [(1S,5S)-6-cyano-1,5-dimethyl-2-oxidanylidene-8-oxabicyclo[3.2.1]oct-3-en-6-yl] ethanoate Openeye Name: [(1S,5S)-6-cyano-1,5-dimethyl-2-oxo-8-oxabicyclo[3.2.1]oct-3-en-6-yl] acetate CAS Name: acetic acid [(1S,5S)-6-cyano-1,5-dimethyl-2-oxo-8-oxabicyclo[3.2.1]oct-3-en-6-yl] ester IUPAC Name: [(1S,5S)-6-cyano-1,5-dimethyl-2-oxo-8-oxabicyclo[3.2.1]oct-3-en-6-yl] acetate Traditional Name: acetic acid [(1S,5S)-6-cyano-2-keto-1,5-dimethyl-8-oxabicyclo[3.2.1]oct-3-en-6-yl] ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CC2(C(=O)C=CC1(O2)C)C)C#N

Isomeric SMILES

CC(=O)OC1(C[C@]2(C(=O)C=C[C@@]1(O2)C)C)C#N

InChI

InChI=1S/C12H13NO4/c1-8(14)16-12(7-13)6-10(2)9(15)4-5-11(12,3)17-10/h4-5H,6H2,1-3H3/t10-,11-,12?/m0/s1