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

Systemtic Name: 5-heptyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane Openeye Name: 5-heptyl-2-[4-[(E)-3-(4-pentylcyclohexyl)allyloxy]phenyl]-1,3-dioxane CAS Name: 5-heptyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane IUPAC Name: 5-heptyl-2-[4-[(E)-3-(4-pentylcyclohexyl)prop-2-enoxy]phenyl]-1,3-dioxane Traditional Name: 2-[4-[(E)-3-(4-amylcyclohexyl)allyloxy]phenyl]-5-heptyl-1,3-dioxane Formula: C31H50O3 MolecularWeight: 470.7269

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H50O3/c1-3-5-7-8-10-13-28-24-33-31(34-25-28)29-19-21-30(22-20-29)32-23-11-14-27-17-15-26(16-18-27)12-9-6-4-2/h11,14,19-22,26-28,31H,3-10,12-13,15-18,23-25H2,1-2H3/b14-11+