(1S,4R)-5-ethanoyl-4,8,8-trimethyl-bicyclo[2.2.2]oct-5-en-2-one

Systemtic Name: (1S,4R)-5-ethanoyl-4,8,8-trimethyl-bicyclo[2.2.2]oct-5-en-2-one Openeye Name: (1S,4R)-5-acetyl-4,8,8-trimethyl-bicyclo[2.2.2]oct-5-en-2-one CAS Name: (1S,4R)-5-acetyl-4,8,8-trimethyl-2-bicyclo[2.2.2]oct-5-enone IUPAC Name: (1S,4R)-5-acetyl-4,8,8-trimethylbicyclo[2.2.2]oct-5-en-2-one Traditional Name: (1S,4R)-5-acetyl-4,8,8-trimethyl-bicyclo[2.2.2]oct-5-en-2-one Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2CC(C1(CC2=O)C)(C)C

Isomeric SMILES

CC(=O)C1=C[C@@H]2CC([C@]1(CC2=O)C)(C)C

InChI

InChI=1S/C13H18O2/c1-8(14)10-5-9-6-12(2,3)13(10,4)7-11(9)15/h5,9H,6-7H2,1-4H3/t9-,13+/m1/s1