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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2CCCC(=O)C2C(O1)CC

Isomeric SMILES

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

InChI

InChI=1S/C12H20O2/c1-3-10-8-6-5-7-9(13)12(8)11(4-2)14-10/h8,10-12H,3-7H2,1-2H3/t8-,10?,11?,12+/m0/s1