4,7-dimethyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione

Systemtic Name: 4,7-dimethyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione Openeye Name: 4,7-dimethyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1,3-dione CAS Name: 4,7-dimethyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1,3-dione IUPAC Name: 4,7-dimethyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione Traditional Name: 4,7-dimethyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1,3-quinone Formula: C10H14O3 MolecularWeight: 182.21636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C2C1C(=O)OC2=O)C

Isomeric SMILES

CC1CCC(C2C1C(=O)OC2=O)C

InChI

InChI=1S/C10H14O3/c1-5-3-4-6(2)8-7(5)9(11)13-10(8)12/h5-8H,3-4H2,1-2H3