bis(2-methylpropyl) (1S,2R,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-(4-propan-2-ylphenyl)cyclohexane-1,3-dicarboxylate

Systemtic Name: bis(2-methylpropyl) (1S,2R,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-(4-propan-2-ylphenyl)cyclohexane-1,3-dicarboxylate Openeye Name: diisobutyl (1S,2R,3R,4S)-4-hydroxy-2-(4-isopropylphenyl)-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate CAS Name: (1S,2R,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-(4-propan-2-ylphenyl)cyclohexane-1,3-dicarboxylic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) (1S,2R,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-(4-propan-2-ylphenyl)cyclohexane-1,3-dicarboxylate Traditional Name: (1S,2R,3R,4S)-4-hydroxy-6-keto-4-methyl-2-p-cumenyl-cyclohexane-1,3-dicarboxylic acid diisobutyl ester Formula: C26H38O6 MolecularWeight: 446.57632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC(C)C)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC(C)COC(=O)[C@H]1[C@@H]([C@H]([C@@](CC1=O)(C)O)C(=O)OCC(C)C)C2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C26H38O6/c1-15(2)13-31-24(28)22-20(27)12-26(7,30)23(25(29)32-14-16(3)4)21(22)19-10-8-18(9-11-19)17(5)6/h8-11,15-17,21-23,30H,12-14H2,1-7H3/t21-,22+,23-,26-/m0/s1