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

Systemtic Name: bis(2-methylpropyl) (1R,2S,3S,4S)-2-(4-methoxycarbonylphenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: diisobutyl (1R,2S,3S,4S)-4-hydroxy-2-(4-methoxycarbonylphenyl)-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate CAS Name: (1R,2S,3S,4S)-4-hydroxy-2-(4-methoxycarbonylphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylic acid bis(2-methylpropyl) ester IUPAC Name: bis(2-methylpropyl) (1R,2S,3S,4S)-4-hydroxy-2-(4-methoxycarbonylphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate Traditional Name: (1R,2S,3S,4S)-2-(4-carbomethoxyphenyl)-4-hydroxy-6-keto-4-methyl-cyclohexane-1,3-dicarboxylic acid diisobutyl ester Formula: C25H34O8 MolecularWeight: 462.53266

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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(=O)OC

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(=O)OC

InChI

InChI=1S/C25H34O8/c1-14(2)12-32-23(28)20-18(26)11-25(5,30)21(24(29)33-13-15(3)4)19(20)16-7-9-17(10-8-16)22(27)31-6/h7-10,14-15,19-21,30H,11-13H2,1-6H3/t19-,20+,21-,25+/m1/s1