ethyl 5-[bis(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-2-oxidanylidene-imidazole-4-carboxylate

Systemtic Name: ethyl 5-[bis(4,4-dimethyl-2-oxidanyl-6-oxidanylidene-cyclohexen-1-yl)methyl]-2-oxidanylidene-imidazole-4-carboxylate Openeye Name: ethyl 5-[bis(2-hydroxy-4,4-dimethyl-6-oxo-cyclohexen-1-yl)methyl]-2-oxo-imidazole-4-carboxylate CAS Name: 5-[bis(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexenyl)methyl]-2-oxo-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[bis(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-2-oxoimidazole-4-carboxylate Traditional Name: 5-[bis(2-hydroxy-6-keto-4,4-dimethyl-cyclohexen-1-yl)methyl]-2-keto-imidazole-4-carboxylic acid ethyl ester Formula: C23H28N2O7 MolecularWeight: 444.47762

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=O)N=C1C(C2=C(CC(CC2=O)(C)C)O)C3=C(CC(CC3=O)(C)C)O

Isomeric SMILES

CCOC(=O)C1=NC(=O)N=C1C(C2=C(CC(CC2=O)(C)C)O)C3=C(CC(CC3=O)(C)C)O

InChI

InChI=1S/C23H28N2O7/c1-6-32-20(30)19-18(24-21(31)25-19)17(15-11(26)7-22(2,3)8-12(15)27)16-13(28)9-23(4,5)10-14(16)29/h17,26,28H,6-10H2,1-5H3