[(2E,4E)-5-methyl-7-oxidanylidene-hepta-2,4-dienyl] 2,2-dimethylpropanoate

Systemtic Name: [(2E,4E)-5-methyl-7-oxidanylidene-hepta-2,4-dienyl] 2,2-dimethylpropanoate Openeye Name: [(2E,4E)-5-methyl-7-oxo-hepta-2,4-dienyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(2E,4E)-5-methyl-7-oxohepta-2,4-dienyl] ester IUPAC Name: [(2E,4E)-5-methyl-7-oxohepta-2,4-dienyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(2E,4E)-7-keto-5-methyl-hepta-2,4-dienyl] ester Formula: C13H20O3 MolecularWeight: 224.2961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC=CCOC(=O)C(C)(C)C)CC=O

Isomeric SMILES

C/C(=C\C=C\COC(=O)C(C)(C)C)/CC=O

InChI

InChI=1S/C13H20O3/c1-11(8-9-14)7-5-6-10-16-12(15)13(2,3)4/h5-7,9H,8,10H2,1-4H3/b6-5+,11-7+