(E)-1-(2,2-dimethylcyclohexyl)but-2-en-1-one

Systemtic Name: (E)-1-(2,2-dimethylcyclohexyl)but-2-en-1-one Openeye Name: (E)-1-(2,2-dimethylcyclohexyl)but-2-en-1-one CAS Name: (E)-1-(2,2-dimethylcyclohexyl)-2-buten-1-one IUPAC Name: (E)-1-(2,2-dimethylcyclohexyl)but-2-en-1-one Traditional Name: (E)-1-(2,2-dimethylcyclohexyl)but-2-en-1-one Formula: C12H20O MolecularWeight: 180.2866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)C1CCCCC1(C)C

Isomeric SMILES

C/C=C/C(=O)C1CCCCC1(C)C

InChI

InChI=1S/C12H20O/c1-4-7-11(13)10-8-5-6-9-12(10,2)3/h4,7,10H,5-6,8-9H2,1-3H3/b7-4+