1-(2,2-diethyl-1,3-dioxan-5-yl)-6-(hydroxymethyl)oct-1-yn-3-one

Systemtic Name: 1-(2,2-diethyl-1,3-dioxan-5-yl)-6-(hydroxymethyl)oct-1-yn-3-one Openeye Name: 1-(2,2-diethyl-1,3-dioxan-5-yl)-6-(hydroxymethyl)oct-1-yn-3-one CAS Name: 1-(2,2-diethyl-1,3-dioxan-5-yl)-6-(hydroxymethyl)-1-octyn-3-one IUPAC Name: 1-(2,2-diethyl-1,3-dioxan-5-yl)-6-(hydroxymethyl)oct-1-yn-3-one Traditional Name: 1-(2,2-diethyl-1,3-dioxan-5-yl)-6-methylol-oct-1-yn-3-one Formula: C17H28O4 MolecularWeight: 296.40182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)C#CC1COC(OC1)(CC)CC)CO

Isomeric SMILES

CCC(CCC(=O)C#CC1COC(OC1)(CC)CC)CO

InChI

InChI=1S/C17H28O4/c1-4-14(11-18)7-9-16(19)10-8-15-12-20-17(5-2,6-3)21-13-15/h14-15,18H,4-7,9,11-13H2,1-3H3