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

Systemtic Name: (2S,6S)-6-hexyl-2-(3-phenylmethoxypropyl)-1,3-dioxan-4-one Openeye Name: (2S,6S)-2-(3-benzyloxypropyl)-6-hexyl-1,3-dioxan-4-one CAS Name: (2S,6S)-6-hexyl-2-(3-phenylmethoxypropyl)-1,3-dioxan-4-one IUPAC Name: (2S,6S)-6-hexyl-2-(3-phenylmethoxypropyl)-1,3-dioxan-4-one Traditional Name: (2S,6S)-2-(3-benzoxypropyl)-6-hexyl-1,3-dioxan-4-one Formula: C20H30O4 MolecularWeight: 334.4498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CC(=O)OC(O1)CCCOCC2=CC=CC=C2

Isomeric SMILES

CCCCCC[C@H]1CC(=O)O[C@H](O1)CCCOCC2=CC=CC=C2

InChI

InChI=1S/C20H30O4/c1-2-3-4-8-12-18-15-19(21)24-20(23-18)13-9-14-22-16-17-10-6-5-7-11-17/h5-7,10-11,18,20H,2-4,8-9,12-16H2,1H3/t18-,20-/m0/s1