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

Systemtic Name: [(3aR,4S,7aR)-3a-methyl-3-oxidanylidene-1,4,5,7a-tetrahydro-2-benzofuran-4-yl] ethanoate Openeye Name: [(3aR,4S,7aR)-3a-methyl-3-oxo-1,4,5,7a-tetrahydroisobenzofuran-4-yl] acetate CAS Name: acetic acid [(3aR,4S,7aR)-3a-methyl-3-oxo-1,4,5,7a-tetrahydroisobenzofuran-4-yl] ester IUPAC Name: [(3aR,4S,7aR)-3a-methyl-3-oxo-1,4,5,7a-tetrahydro-2-benzofuran-4-yl] acetate Traditional Name: acetic acid [(3aR,4S,7aR)-3-keto-3a-methyl-1,4,5,7a-tetrahydroisobenzofuran-4-yl] ester Formula: C11H14O4 MolecularWeight: 210.22646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC=CC2C1(C(=O)OC2)C

Isomeric SMILES

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

InChI

InChI=1S/C11H14O4/c1-7(12)15-9-5-3-4-8-6-14-10(13)11(8,9)2/h3-4,8-9H,5-6H2,1-2H3/t8-,9-,11+/m0/s1