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

Systemtic Name: bis(2-methylpropyl) (1R,2S,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-2-phenyl-cyclohexane-1,3-dicarboxylate Openeye Name: diisobutyl (1R,2S,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-phenyl-cyclohexane-1,3-dicarboxylate CAS Name: (1R,2S,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) (1R,2S,3R,4S)-4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylate Traditional Name: (1R,2S,3R,4S)-4-hydroxy-6-keto-4-methyl-2-phenyl-cyclohexane-1,3-dicarboxylic acid diisobutyl ester Formula: C23H32O6 MolecularWeight: 404.49658

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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=CC=C2

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=CC=C2

InChI

InChI=1S/C23H32O6/c1-14(2)12-28-21(25)19-17(24)11-23(5,27)20(22(26)29-13-15(3)4)18(19)16-9-7-6-8-10-16/h6-10,14-15,18-20,27H,11-13H2,1-5H3/t18-,19+,20+,23+/m1/s1