2-[1-(2,3-dimethoxyphenyl)-4-oxidanylidene-cyclohex-2-en-1-yl]ethyl 2,2-dimethylpropanoate

Systemtic Name: 2-[1-(2,3-dimethoxyphenyl)-4-oxidanylidene-cyclohex-2-en-1-yl]ethyl 2,2-dimethylpropanoate Openeye Name: 2-[1-(2,3-dimethoxyphenyl)-4-oxo-cyclohex-2-en-1-yl]ethyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 2-[1-(2,3-dimethoxyphenyl)-4-oxo-1-cyclohex-2-enyl]ethyl ester IUPAC Name: 2-[1-(2,3-dimethoxyphenyl)-4-oxocyclohex-2-en-1-yl]ethyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 2-[1-(2,3-dimethoxyphenyl)-4-keto-cyclohex-2-en-1-yl]ethyl ester Formula: C21H28O5 MolecularWeight: 360.44402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCC1(CCC(=O)C=C1)C2=C(C(=CC=C2)OC)OC

Isomeric SMILES

CC(C)(C)C(=O)OCCC1(CCC(=O)C=C1)C2=C(C(=CC=C2)OC)OC

InChI

InChI=1S/C21H28O5/c1-20(2,3)19(23)26-14-13-21(11-9-15(22)10-12-21)16-7-6-8-17(24-4)18(16)25-5/h6-9,11H,10,12-14H2,1-5H3