tert-butyl 3-[1-(3,4-dimethoxyphenyl)-2,4-bis(oxidanylidene)cyclohexyl]propanoate

Systemtic Name: tert-butyl 3-[1-(3,4-dimethoxyphenyl)-2,4-bis(oxidanylidene)cyclohexyl]propanoate Openeye Name: tert-butyl 3-[1-(3,4-dimethoxyphenyl)-2,4-dioxo-cyclohexyl]propanoate CAS Name: 3-[1-(3,4-dimethoxyphenyl)-2,4-dioxocyclohexyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-(3,4-dimethoxyphenyl)-2,4-dioxocyclohexyl]propanoate Traditional Name: 3-[1-(3,4-dimethoxyphenyl)-2,4-diketo-cyclohexyl]propionic acid tert-butyl ester Formula: C21H28O6 MolecularWeight: 376.44342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1(CCC(=O)CC1=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCC1(CCC(=O)CC1=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H28O6/c1-20(2,3)27-19(24)9-11-21(10-8-15(22)13-18(21)23)14-6-7-16(25-4)17(12-14)26-5/h6-7,12H,8-11,13H2,1-5H3