(2S,5S,6S)-6-hexyl-2,5-dimethyl-1,3-dioxan-4-one

Systemtic Name: (2S,5S,6S)-6-hexyl-2,5-dimethyl-1,3-dioxan-4-one Openeye Name: (2S,5S,6S)-6-hexyl-2,5-dimethyl-1,3-dioxan-4-one CAS Name: (2S,5S,6S)-6-hexyl-2,5-dimethyl-1,3-dioxan-4-one IUPAC Name: (2S,5S,6S)-6-hexyl-2,5-dimethyl-1,3-dioxan-4-one Traditional Name: (2S,5S,6S)-6-hexyl-2,5-dimethyl-1,3-dioxan-4-one Formula: C12H22O3 MolecularWeight: 214.30128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(C(=O)OC(O1)C)C

Isomeric SMILES

CCCCCC[C@H]1[C@@H](C(=O)O[C@H](O1)C)C

InChI

InChI=1S/C12H22O3/c1-4-5-6-7-8-11-9(2)12(13)15-10(3)14-11/h9-11H,4-8H2,1-3H3/t9-,10-,11-/m0/s1