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

Systemtic Name: 5-hexyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane Openeye Name: 5-hexyl-2-[4-[(E)-3-(4-pentylcyclohexyl)allyloxy]phenyl]-1,3-dioxane CAS Name: 5-hexyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane IUPAC Name: 5-hexyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane Traditional Name: 2-[4-[(E)-3-(4-amylcyclohexyl)allyloxy]phenyl]-5-hexyl-1,3-dioxane Formula: C30H48O3 MolecularWeight: 456.70032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1COC(OC1)C2=CC=C(C=C2)OCC=CC3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCC1COC(OC1)C2=CC=C(C=C2)OC/C=C/C3CCC(CC3)CCCCC

InChI

InChI=1S/C30H48O3/c1-3-5-7-9-12-27-23-32-30(33-24-27)28-18-20-29(21-19-28)31-22-10-13-26-16-14-25(15-17-26)11-8-6-4-2/h10,13,18-21,25-27,30H,3-9,11-12,14-17,22-24H2,1-2H3/b13-10+