ethyl 3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3-(3,4,5-trimethoxyphenyl)propanoate

Systemtic Name: ethyl 3-(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)-3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: ethyl 3-(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)-3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)-3-(3,4,5-trimethoxyphenyl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-3-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)-3-(3,4,5-trimethoxyphenyl)propionic acid ethyl ester Formula: C22H30O7 MolecularWeight: 406.4694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C1=CC(=C(C(=C1)OC)OC)OC)C2=C(CC(CC2=O)(C)C)O

Isomeric SMILES

CCOC(=O)CC(C1=CC(=C(C(=C1)OC)OC)OC)C2=C(CC(CC2=O)(C)C)O

InChI

InChI=1S/C22H30O7/c1-7-29-19(25)10-14(20-15(23)11-22(2,3)12-16(20)24)13-8-17(26-4)21(28-6)18(9-13)27-5/h8-9,14,23H,7,10-12H2,1-6H3