[(3aR,4R,7aR)-7,7a-dimethyl-1-oxidanylidene-3,3a,4,5-tetrahydro-2-benzofuran-4-yl] ethanoate

Systemtic Name: [(3aR,4R,7aR)-7,7a-dimethyl-1-oxidanylidene-3,3a,4,5-tetrahydro-2-benzofuran-4-yl] ethanoate Openeye Name: [(3aR,4R,7aR)-7,7a-dimethyl-1-oxo-3,3a,4,5-tetrahydroisobenzofuran-4-yl] acetate CAS Name: acetic acid [(3aR,4R,7aR)-7,7a-dimethyl-1-oxo-3,3a,4,5-tetrahydroisobenzofuran-4-yl] ester IUPAC Name: [(3aR,4R,7aR)-7,7a-dimethyl-1-oxo-3,3a,4,5-tetrahydro-2-benzofuran-4-yl] acetate Traditional Name: acetic acid [(3aR,4R,7aR)-1-keto-7,7a-dimethyl-3,3a,4,5-tetrahydroisobenzofuran-4-yl] ester Formula: C12H16O4 MolecularWeight: 224.25304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C2C1(C(=O)OC2)C)OC(=O)C

Isomeric SMILES

CC1=CC[C@H]([C@@H]2[C@]1(C(=O)OC2)C)OC(=O)C

InChI

InChI=1S/C12H16O4/c1-7-4-5-10(16-8(2)13)9-6-15-11(14)12(7,9)3/h4,9-10H,5-6H2,1-3H3/t9-,10-,12+/m1/s1