(3aS,7aS)-3,3-diethyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1-one

Systemtic Name: (3aS,7aS)-3,3-diethyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1-one Openeye Name: (3aS,7aS)-3,3-diethyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1-one CAS Name: (3aS,7aS)-3,3-diethyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1-one IUPAC Name: (3aS,7aS)-3,3-diethyl-3a,4,5,6,7,7a-hexahydro-2-benzofuran-1-one Traditional Name: (3aS,7aS)-3,3-diethyl-3a,4,5,6,7,7a-hexahydroisobenzofuran-1-one Formula: C12H20O2 MolecularWeight: 196.286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2CCCCC2C(=O)O1)CC

Isomeric SMILES

CCC1([C@H]2CCCC[C@@H]2C(=O)O1)CC

InChI

InChI=1S/C12H20O2/c1-3-12(4-2)10-8-6-5-7-9(10)11(13)14-12/h9-10H,3-8H2,1-2H3/t9-,10-/m0/s1