5-heptyl-2-[4-[(E)-3-(4-propylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane

Systemtic Name: 5-heptyl-2-[4-[(E)-3-(4-propylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane Openeye Name: 5-heptyl-2-[4-[(E)-3-(4-propylcyclohexyl)allyloxy]phenyl]-1,3-dioxane CAS Name: 5-heptyl-2-[4-[(E)-3-(4-propylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane IUPAC Name: 5-heptyl-2-[4-[(E)-3-(4-propylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane Traditional Name: 5-heptyl-2-[4-[(E)-3-(4-propylcyclohexyl)allyloxy]phenyl]-1,3-dioxane Formula: C29H46O3 MolecularWeight: 442.67374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)C2=CC=C(C=C2)OCC=CC3CCC(CC3)CCC

Isomeric SMILES

CCCCCCCC1COC(OC1)C2=CC=C(C=C2)OC/C=C/C3CCC(CC3)CCC

InChI

InChI=1S/C29H46O3/c1-3-5-6-7-8-11-26-22-31-29(32-23-26)27-17-19-28(20-18-27)30-21-9-12-25-15-13-24(10-4-2)14-16-25/h9,12,17-20,24-26,29H,3-8,10-11,13-16,21-23H2,1-2H3/b12-9+