ethyl 2-(2,4,4-trimethyl-6-oxidanylidene-cyclohexen-1-yl)ethanoate

Systemtic Name: ethyl 2-(2,4,4-trimethyl-6-oxidanylidene-cyclohexen-1-yl)ethanoate Openeye Name: ethyl 2-(2,4,4-trimethyl-6-oxo-cyclohexen-1-yl)acetate CAS Name: 2-(2,4,4-trimethyl-6-oxo-1-cyclohexenyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(2,4,4-trimethyl-6-oxocyclohexen-1-yl)acetate Traditional Name: 2-(6-keto-2,4,4-trimethyl-cyclohexen-1-yl)acetic acid ethyl ester Formula: C13H20O3 MolecularWeight: 224.2961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(CC(CC1=O)(C)C)C

Isomeric SMILES

CCOC(=O)CC1=C(CC(CC1=O)(C)C)C

InChI

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