(1S,5R)-6-ethanoyl-5,9,9-trimethyl-2-oxabicyclo[3.2.2]non-6-en-3-one

Systemtic Name: (1S,5R)-6-ethanoyl-5,9,9-trimethyl-2-oxabicyclo[3.2.2]non-6-en-3-one Openeye Name: (1S,5R)-6-acetyl-5,9,9-trimethyl-2-oxabicyclo[3.2.2]non-6-en-3-one CAS Name: (1S,5R)-6-acetyl-5,9,9-trimethyl-2-oxabicyclo[3.2.2]non-6-en-3-one IUPAC Name: (1S,5R)-6-acetyl-5,9,9-trimethyl-2-oxabicyclo[3.2.2]non-6-en-3-one Traditional Name: (1S,5R)-6-acetyl-5,9,9-trimethyl-2-oxabicyclo[3.2.2]non-6-en-3-one Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2CC(C1(CC(=O)O2)C)(C)C

Isomeric SMILES

CC(=O)C1=C[C@@H]2CC([C@]1(CC(=O)O2)C)(C)C

InChI

InChI=1S/C13H18O3/c1-8(14)10-5-9-6-12(2,3)13(10,4)7-11(15)16-9/h5,9H,6-7H2,1-4H3/t9-,13+/m1/s1