(3aS,6S,6aR)-3a,6-dimethyl-6a-oxidanyl-2-propan-2-yloxy-5,6-dihydro-4H-pentalen-1-one

Systemtic Name: (3aS,6S,6aR)-3a,6-dimethyl-6a-oxidanyl-2-propan-2-yloxy-5,6-dihydro-4H-pentalen-1-one Openeye Name: (3aS,6S,6aR)-6a-hydroxy-2-isopropoxy-3a,6-dimethyl-5,6-dihydro-4H-pentalen-1-one CAS Name: (3aS,6S,6aR)-6a-hydroxy-3a,6-dimethyl-2-propan-2-yloxy-5,6-dihydro-4H-pentalen-1-one IUPAC Name: (3aS,6S,6aR)-6a-hydroxy-3a,6-dimethyl-2-propan-2-yloxy-5,6-dihydro-4H-pentalen-1-one Traditional Name: (3aS,6S,6aR)-6a-hydroxy-2-isopropoxy-3a,6-dimethyl-5,6-dihydro-4H-pentalen-1-one Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2(C1(C(=O)C(=C2)OC(C)C)O)C

Isomeric SMILES

C[C@H]1CC[C@@]2([C@]1(C(=O)C(=C2)OC(C)C)O)C

InChI

InChI=1S/C13H20O3/c1-8(2)16-10-7-12(4)6-5-9(3)13(12,15)11(10)14/h7-9,15H,5-6H2,1-4H3/t9-,12-,13-/m0/s1