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

Systemtic Name: dipropan-2-yl (1S,2S,3R,4S)-2-(4-methoxyphenyl)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: diisopropyl (1S,2S,3R,4S)-4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate CAS Name: (1S,2S,3R,4S)-4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl (1S,2S,3R,4S)-4-hydroxy-2-(4-methoxyphenyl)-4-methyl-6-oxocyclohexane-1,3-dicarboxylate Traditional Name: (1S,2S,3R,4S)-4-hydroxy-6-keto-2-(4-methoxyphenyl)-4-methyl-cyclohexane-1,3-dicarboxylic acid diisopropyl ester Formula: C22H30O7 MolecularWeight: 406.4694

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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

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

InChI

InChI=1S/C22H30O7/c1-12(2)28-20(24)18-16(23)11-22(5,26)19(21(25)29-13(3)4)17(18)14-7-9-15(27-6)10-8-14/h7-10,12-13,17-19,26H,11H2,1-6H3/t17-,18-,19+,22+/m1/s1