2-[2-[4-(4-butylcyclohexyl)-2-fluoranyl-phenyl]ethyl]-5-heptyl-1,3-dioxane

Systemtic Name: 2-[2-[4-(4-butylcyclohexyl)-2-fluoranyl-phenyl]ethyl]-5-heptyl-1,3-dioxane Openeye Name: 2-[2-[4-(4-butylcyclohexyl)-2-fluoro-phenyl]ethyl]-5-heptyl-1,3-dioxane CAS Name: 2-[2-[4-(4-butylcyclohexyl)-2-fluorophenyl]ethyl]-5-heptyl-1,3-dioxane IUPAC Name: 2-[2-[4-(4-butylcyclohexyl)-2-fluorophenyl]ethyl]-5-heptyl-1,3-dioxane Traditional Name: 2-[2-[4-(4-butylcyclohexyl)-2-fluoro-phenyl]ethyl]-5-heptyl-1,3-dioxane Formula: C29H47FO2 MolecularWeight: 446.680683

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)CCC2=C(C=C(C=C2)C3CCC(CC3)CCCC)F

Isomeric SMILES

CCCCCCCC1COC(OC1)CCC2=C(C=C(C=C2)C3CCC(CC3)CCCC)F

InChI

InChI=1S/C29H47FO2/c1-3-5-7-8-9-11-24-21-31-29(32-22-24)19-18-26-16-17-27(20-28(26)30)25-14-12-23(13-15-25)10-6-4-2/h16-17,20,23-25,29H,3-15,18-19,21-22H2,1-2H3