[2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl] 4-tert-butylcyclohexane-1-carboxylate

Systemtic Name: [2-(2,5-dimethoxyphenyl)-2-oxidanylidene-ethyl] 4-tert-butylcyclohexane-1-carboxylate Openeye Name: [2-(2,5-dimethoxyphenyl)-2-oxo-ethyl] 4-tert-butylcyclohexanecarboxylate CAS Name: 4-tert-butyl-1-cyclohexanecarboxylic acid [2-(2,5-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethoxyphenyl)-2-oxoethyl] 4-tert-butylcyclohexane-1-carboxylate Traditional Name: 4-tert-butylcyclohexanecarboxylic acid [2-(2,5-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C21H30O5 MolecularWeight: 362.4599

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)C(=O)OCC(=O)C2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CC(C)(C)C1CCC(CC1)C(=O)OCC(=O)C2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C21H30O5/c1-21(2,3)15-8-6-14(7-9-15)20(23)26-13-18(22)17-12-16(24-4)10-11-19(17)25-5/h10-12,14-15H,6-9,13H2,1-5H3