[(5R,6R,7aS)-3,3,6-trimethyl-7a-oxidanyl-6,7-dihydro-5H-1,2-benzodioxol-5-yl] ethanoate

Systemtic Name: [(5R,6R,7aS)-3,3,6-trimethyl-7a-oxidanyl-6,7-dihydro-5H-1,2-benzodioxol-5-yl] ethanoate Openeye Name: [(5R,6R,7aS)-7a-hydroxy-3,3,6-trimethyl-6,7-dihydro-5H-1,2-benzodioxol-5-yl] acetate CAS Name: acetic acid [(5R,6R,7aS)-7a-hydroxy-3,3,6-trimethyl-6,7-dihydro-5H-1,2-benzodioxol-5-yl] ester IUPAC Name: [(5R,6R,7aS)-7a-hydroxy-3,3,6-trimethyl-6,7-dihydro-5H-1,2-benzodioxol-5-yl] acetate Traditional Name: acetic acid [(5R,6R,7aS)-7a-hydroxy-3,3,6-trimethyl-6,7-dihydro-5H-1,2-benzodioxol-5-yl] ester Formula: C12H18O5 MolecularWeight: 242.26832

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2(C(=CC1OC(=O)C)C(OO2)(C)C)O

Isomeric SMILES

C[C@@H]1C[C@]2(C(=C[C@@H]1OC(=O)C)C(OO2)(C)C)O

InChI

InChI=1S/C12H18O5/c1-7-6-12(14)10(11(3,4)16-17-12)5-9(7)15-8(2)13/h5,7,9,14H,6H2,1-4H3/t7-,9+,12+/m1/s1