[(5S,6S)-3,6-dimethyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-5-yl] ethanoate

Systemtic Name: [(5S,6S)-3,6-dimethyl-4-oxidanylidene-6,7-dihydro-5H-1-benzofuran-5-yl] ethanoate Openeye Name: [(5S,6S)-3,6-dimethyl-4-oxo-6,7-dihydro-5H-benzofuran-5-yl] acetate CAS Name: acetic acid [(5S,6S)-3,6-dimethyl-4-oxo-6,7-dihydro-5H-benzofuran-5-yl] ester IUPAC Name: [(5S,6S)-3,6-dimethyl-4-oxo-6,7-dihydro-5H-1-benzofuran-5-yl] acetate Traditional Name: acetic acid [(5S,6S)-4-keto-3,6-dimethyl-6,7-dihydro-5H-benzofuran-5-yl] ester Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C(=CO2)C)C(=O)C1OC(=O)C

Isomeric SMILES

C[C@H]1CC2=C(C(=CO2)C)C(=O)[C@H]1OC(=O)C

InChI

InChI=1S/C12H14O4/c1-6-4-9-10(7(2)5-15-9)11(14)12(6)16-8(3)13/h5-6,12H,4H2,1-3H3/t6-,12-/m0/s1