diethyl 1-(1-benzofuran-5-yl)-2,2,6-trimethyl-6-oxidanyl-4-oxidanylidene-cyclohexane-1,3-dicarboxylate

Systemtic Name: diethyl 1-(1-benzofuran-5-yl)-2,2,6-trimethyl-6-oxidanyl-4-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: diethyl 1-(benzofuran-5-yl)-6-hydroxy-2,2,6-trimethyl-4-oxo-cyclohexane-1,3-dicarboxylate CAS Name: 1-(5-benzofuranyl)-6-hydroxy-2,2,6-trimethyl-4-oxocyclohexane-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1-(1-benzofuran-5-yl)-6-hydroxy-2,2,6-trimethyl-4-oxocyclohexane-1,3-dicarboxylate Traditional Name: 1-(benzofuran-5-yl)-6-hydroxy-4-keto-2,2,6-trimethyl-cyclohexane-1,3-dicarboxylic acid diethyl ester Formula: C23H28O7 MolecularWeight: 416.46422

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(=O)CC(C(C1(C)C)(C2=CC3=C(C=C2)OC=C3)C(=O)OCC)(C)O

Isomeric SMILES

CCOC(=O)C1C(=O)CC(C(C1(C)C)(C2=CC3=C(C=C2)OC=C3)C(=O)OCC)(C)O

InChI

InChI=1S/C23H28O7/c1-6-28-19(25)18-16(24)13-22(5,27)23(21(18,3)4,20(26)29-7-2)15-8-9-17-14(12-15)10-11-30-17/h8-12,18,27H,6-7,13H2,1-5H3