[(1S,2S)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-cyclohexyl] 2,2-dimethylpropanoate

Systemtic Name: [(1S,2S)-2-(3,4-dimethoxyphenyl)-2-oxidanyl-cyclohexyl] 2,2-dimethylpropanoate Openeye Name: [(1S,2S)-2-(3,4-dimethoxyphenyl)-2-hydroxy-cyclohexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(1S,2S)-2-(3,4-dimethoxyphenyl)-2-hydroxycyclohexyl] ester IUPAC Name: [(1S,2S)-2-(3,4-dimethoxyphenyl)-2-hydroxycyclohexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(1S,2S)-2-(3,4-dimethoxyphenyl)-2-hydroxy-cyclohexyl] ester Formula: C19H28O5 MolecularWeight: 336.42262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1CCCCC1(C2=CC(=C(C=C2)OC)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C19H28O5/c1-18(2,3)17(20)24-16-8-6-7-11-19(16,21)13-9-10-14(22-4)15(12-13)23-5/h9-10,12,16,21H,6-8,11H2,1-5H3/t16-,19-/m0/s1