5-hexyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane

Systemtic Name: 5-hexyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane Openeye Name: 5-hexyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane CAS Name: 5-hexyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane IUPAC Name: 5-hexyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane Traditional Name: 5-hexyl-5-methyl-2-(4-propylphenyl)-1,3-dioxane Formula: C20H32O2 MolecularWeight: 304.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(COC(OC1)C2=CC=C(C=C2)CCC)C

Isomeric SMILES

CCCCCCC1(COC(OC1)C2=CC=C(C=C2)CCC)C

InChI

InChI=1S/C20H32O2/c1-4-6-7-8-14-20(3)15-21-19(22-16-20)18-12-10-17(9-5-2)11-13-18/h10-13,19H,4-9,14-16H2,1-3H3