diethyl 4-methyl-4-oxidanyl-6-oxidanylidene-2-(2,4,5-trimethoxyphenyl)cyclohexane-1,3-dicarboxylate

Systemtic Name: diethyl 4-methyl-4-oxidanyl-6-oxidanylidene-2-(2,4,5-trimethoxyphenyl)cyclohexane-1,3-dicarboxylate Openeye Name: diethyl 4-hydroxy-4-methyl-6-oxo-2-(2,4,5-trimethoxyphenyl)cyclohexane-1,3-dicarboxylate CAS Name: 4-hydroxy-4-methyl-6-oxo-2-(2,4,5-trimethoxyphenyl)cyclohexane-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-hydroxy-4-methyl-6-oxo-2-(2,4,5-trimethoxyphenyl)cyclohexane-1,3-dicarboxylate Traditional Name: 2-asaryl-4-hydroxy-6-keto-4-methyl-cyclohexane-1,3-dicarboxylic acid diethyl ester Formula: C22H30O9 MolecularWeight: 438.4682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC)C2=CC(=C(C=C2OC)OC)OC

Isomeric SMILES

CCOC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC)C2=CC(=C(C=C2OC)OC)OC

InChI

InChI=1S/C22H30O9/c1-7-30-20(24)18-13(23)11-22(3,26)19(21(25)31-8-2)17(18)12-9-15(28-5)16(29-6)10-14(12)27-4/h9-10,17-19,26H,7-8,11H2,1-6H3