4-[(1E)-buta-1,3-dienyl]-3,5,5-trimethyl-cyclohex-2-en-1-one

Systemtic Name: 4-[(1E)-buta-1,3-dienyl]-3,5,5-trimethyl-cyclohex-2-en-1-one Openeye Name: 4-[(1E)-buta-1,3-dienyl]-3,5,5-trimethyl-cyclohex-2-en-1-one CAS Name: 4-[(1E)-buta-1,3-dienyl]-3,5,5-trimethyl-1-cyclohex-2-enone IUPAC Name: 4-[(1E)-buta-1,3-dienyl]-3,5,5-trimethylcyclohex-2-en-1-one Traditional Name: 4-[(1E)-buta-1,3-dienyl]-3,5,5-trimethyl-cyclohex-2-en-1-one Formula: C13H18O MolecularWeight: 190.28142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1C=CC=C)(C)C

Isomeric SMILES

CC1=CC(=O)CC(C1/C=C/C=C)(C)C

InChI

InChI=1S/C13H18O/c1-5-6-7-12-10(2)8-11(14)9-13(12,3)4/h5-8,12H,1,9H2,2-4H3/b7-6+