5-[2-(1-decan-4-ylcyclohexyl)ethyl]-2-(4-fluorophenyl)-1,3-dioxane

Systemtic Name: 5-[2-(1-decan-4-ylcyclohexyl)ethyl]-2-(4-fluorophenyl)-1,3-dioxane Openeye Name: 2-(4-fluorophenyl)-5-[2-[1-(1-propylheptyl)cyclohexyl]ethyl]-1,3-dioxane CAS Name: 5-[2-(1-decan-4-ylcyclohexyl)ethyl]-2-(4-fluorophenyl)-1,3-dioxane IUPAC Name: 5-[2-(1-decan-4-ylcyclohexyl)ethyl]-2-(4-fluorophenyl)-1,3-dioxane Traditional Name: 2-(4-fluorophenyl)-5-[2-[1-(1-propylheptyl)cyclohexyl]ethyl]-1,3-dioxane Formula: C28H45FO2 MolecularWeight: 432.654103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC)C1(CCCCC1)CCC2COC(OC2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCC(CCC)C1(CCCCC1)CCC2COC(OC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C28H45FO2/c1-3-5-6-8-12-25(11-4-2)28(18-9-7-10-19-28)20-17-23-21-30-27(31-22-23)24-13-15-26(29)16-14-24/h13-16,23,25,27H,3-12,17-22H2,1-2H3