3-[(1S,2S)-2-(2-hydroxyethyl)-1,3,3-trimethyl-cyclohexyl]pentane-1,4-diol

Systemtic Name: 3-[(1S,2S)-2-(2-hydroxyethyl)-1,3,3-trimethyl-cyclohexyl]pentane-1,4-diol Openeye Name: 3-[(1S,2S)-2-(2-hydroxyethyl)-1,3,3-trimethyl-cyclohexyl]pentane-1,4-diol CAS Name: 3-[(1S,2S)-2-(2-hydroxyethyl)-1,3,3-trimethylcyclohexyl]pentane-1,4-diol IUPAC Name: 3-[(1S,2S)-2-(2-hydroxyethyl)-1,3,3-trimethylcyclohexyl]pentane-1,4-diol Traditional Name: 3-[(1S,2S)-2-(2-hydroxyethyl)-1,3,3-trimethyl-cyclohexyl]pentane-1,4-diol Formula: C16H32O3 MolecularWeight: 272.42348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCO)C1(CCCC(C1CCO)(C)C)C)O

Isomeric SMILES

CC(C(CCO)[C@]1(CCCC([C@@H]1CCO)(C)C)C)O

InChI

InChI=1S/C16H32O3/c1-12(19)13(6-10-17)16(4)9-5-8-15(2,3)14(16)7-11-18/h12-14,17-19H,5-11H2,1-4H3/t12?,13?,14-,16+/m0/s1