[(3aS,4R,7aS)-2,2-dimethyl-7-oxidanylidene-4,7a-dihydro-3aH-1,3-benzodioxol-4-yl] ethanoate

Systemtic Name: [(3aS,4R,7aS)-2,2-dimethyl-7-oxidanylidene-4,7a-dihydro-3aH-1,3-benzodioxol-4-yl] ethanoate Openeye Name: [(3aS,4R,7aS)-2,2-dimethyl-7-oxo-4,7a-dihydro-3aH-1,3-benzodioxol-4-yl] acetate CAS Name: acetic acid [(3aS,4R,7aS)-2,2-dimethyl-7-oxo-4,7a-dihydro-3aH-1,3-benzodioxol-4-yl] ester IUPAC Name: [(3aS,4R,7aS)-2,2-dimethyl-7-oxo-4,7a-dihydro-3aH-1,3-benzodioxol-4-yl] acetate Traditional Name: acetic acid [(3aS,4R,7aS)-7-keto-2,2-dimethyl-4,7a-dihydro-3aH-1,3-benzodioxol-4-yl] ester Formula: C11H14O5 MolecularWeight: 226.22586

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CC(=O)C2C1OC(O2)(C)C

Isomeric SMILES

CC(=O)O[C@@H]1C=CC(=O)[C@@H]2[C@H]1OC(O2)(C)C

InChI

InChI=1S/C11H14O5/c1-6(12)14-8-5-4-7(13)9-10(8)16-11(2,3)15-9/h4-5,8-10H,1-3H3/t8-,9-,10+/m1/s1