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

Systemtic Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluoranyl-phenyl]phenyl]-5-propyl-1,3-dioxane Openeye Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluoro-phenyl]phenyl]-5-propyl-1,3-dioxane CAS Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluorophenyl]phenyl]-5-propyl-1,3-dioxane IUPAC Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluorophenyl]phenyl]-5-propyl-1,3-dioxane Traditional Name: 2-[4-[4-(4-butylcyclohexyl)-2-fluoro-phenyl]phenyl]-5-propyl-1,3-dioxane Formula: C29H39FO2 MolecularWeight: 438.617163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C2=CC(=C(C=C2)C3=CC=C(C=C3)C4OCC(CO4)CCC)F

Isomeric SMILES

CCCCC1CCC(CC1)C2=CC(=C(C=C2)C3=CC=C(C=C3)C4OCC(CO4)CCC)F

InChI

InChI=1S/C29H39FO2/c1-3-5-7-21-8-10-23(11-9-21)26-16-17-27(28(30)18-26)24-12-14-25(15-13-24)29-31-19-22(6-4-2)20-32-29/h12-18,21-23,29H,3-11,19-20H2,1-2H3