2-(2,6,6-trimethyl-5-oxidanylidene-cyclohexen-1-yl)ethyl ethanoate

Systemtic Name: 2-(2,6,6-trimethyl-5-oxidanylidene-cyclohexen-1-yl)ethyl ethanoate Openeye Name: 2-(2,6,6-trimethyl-5-oxo-cyclohexen-1-yl)ethyl acetate CAS Name: acetic acid 2-(2,6,6-trimethyl-5-oxo-1-cyclohexenyl)ethyl ester IUPAC Name: 2-(2,6,6-trimethyl-5-oxocyclohexen-1-yl)ethyl acetate Traditional Name: acetic acid 2-(5-keto-2,6,6-trimethyl-cyclohexen-1-yl)ethyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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