dipropan-2-yl (1S,2S,3R,4S)-2-(3,4-dimethoxyphenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate

Systemtic Name: dipropan-2-yl (1S,2S,3R,4S)-2-(3,4-dimethoxyphenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: diisopropyl (1S,2S,3R,4S)-2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate CAS Name: (1S,2S,3R,4S)-2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl (1S,2S,3R,4S)-2-(3,4-dimethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate Traditional Name: (1S,2S,3R,4S)-2-(3,4-dimethoxyphenyl)-4-hydroxy-6-keto-4-methyl-cyclohexane-1,3-dicarboxylic acid diisopropyl ester Formula: C23H32O8 MolecularWeight: 436.49538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OC(C)C)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H32O8/c1-12(2)30-21(25)19-15(24)11-23(5,27)20(22(26)31-13(3)4)18(19)14-8-9-16(28-6)17(10-14)29-7/h8-10,12-13,18-20,27H,11H2,1-7H3/t18-,19-,20+,23+/m1/s1