ethyl 2,2-dimethyl-4,6-bis(oxidanylidene)-5-(2-phenethyloxycarbonylprop-2-enyl)cyclohexane-1-carboxylate

Systemtic Name: ethyl 2,2-dimethyl-4,6-bis(oxidanylidene)-5-(2-phenethyloxycarbonylprop-2-enyl)cyclohexane-1-carboxylate Openeye Name: ethyl 2,2-dimethyl-4,6-dioxo-5-(2-phenethyloxycarbonylallyl)cyclohexanecarboxylate CAS Name: 2,2-dimethyl-4,6-dioxo-5-[2-[oxo(phenethyloxy)methyl]prop-2-enyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-4,6-dioxo-5-(2-phenethyloxycarbonylprop-2-enyl)cyclohexane-1-carboxylate Traditional Name: 4,6-diketo-2,2-dimethyl-5-(2-phenethyloxycarbonylallyl)cyclohexanecarboxylic acid ethyl ester Formula: C23H28O6 MolecularWeight: 400.46482

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=O)C(C(=O)CC1(C)C)CC(=C)C(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1C(=O)C(C(=O)CC1(C)C)CC(=C)C(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C23H28O6/c1-5-28-22(27)19-20(25)17(18(24)14-23(19,3)4)13-15(2)21(26)29-12-11-16-9-7-6-8-10-16/h6-10,17,19H,2,5,11-14H2,1,3-4H3