(E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)but-2-en-1-one

Systemtic Name: (E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)but-2-en-1-one Openeye Name: (E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)but-2-en-1-one CAS Name: (E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)-2-buten-1-one IUPAC Name: (E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)but-2-en-1-one Traditional Name: (E)-1-(5,8,8-trimethyl-2,3-dioxabicyclo[2.2.2]oct-5-en-4-yl)but-2-en-1-one Formula: C13H18O3 MolecularWeight: 222.28022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C12C(=CC(CC1(C)C)OO2)C

Isomeric SMILES

C/C=C/C(=O)C12C(=CC(CC1(C)C)OO2)C

InChI

InChI=1S/C13H18O3/c1-5-6-11(14)13-9(2)7-10(15-16-13)8-12(13,3)4/h5-7,10H,8H2,1-4H3/b6-5+