(2S,5S)-5-hexyl-1,4-dioxane-2-carboxylic acid

Systemtic Name: (2S,5S)-5-hexyl-1,4-dioxane-2-carboxylic acid Openeye Name: (2S,5S)-5-hexyl-1,4-dioxane-2-carboxylic acid CAS Name: (2S,5S)-5-hexyl-1,4-dioxane-2-carboxylic acid IUPAC Name: (2S,5S)-5-hexyl-1,4-dioxane-2-carboxylic acid Traditional Name: (2S,5S)-5-hexyl-1,4-dioxane-2-carboxylic acid Formula: C11H20O4 MolecularWeight: 216.2741

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1COC(CO1)C(=O)O

Isomeric SMILES

CCCCCC[C@H]1CO[C@@H](CO1)C(=O)O

InChI

InChI=1S/C11H20O4/c1-2-3-4-5-6-9-7-15-10(8-14-9)11(12)13/h9-10H,2-8H2,1H3,(H,12,13)/t9-,10-/m0/s1