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

Systemtic Name: 2-[2-[4-(2-fluoranyl-4-heptyl-phenyl)phenyl]ethyl]-5-propyl-1,3-dioxane Openeye Name: 2-[2-[4-(2-fluoro-4-heptyl-phenyl)phenyl]ethyl]-5-propyl-1,3-dioxane CAS Name: 2-[2-[4-(2-fluoro-4-heptylphenyl)phenyl]ethyl]-5-propyl-1,3-dioxane IUPAC Name: 2-[2-[4-(2-fluoro-4-heptylphenyl)phenyl]ethyl]-5-propyl-1,3-dioxane Traditional Name: 2-[2-[4-(2-fluoro-4-heptyl-phenyl)phenyl]ethyl]-5-propyl-1,3-dioxane Formula: C28H39FO2 MolecularWeight: 426.606463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)CCC3OCC(CO3)CCC)F

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)C2=CC=C(C=C2)CCC3OCC(CO3)CCC)F

InChI

InChI=1S/C28H39FO2/c1-3-5-6-7-8-10-23-13-17-26(27(29)19-23)25-15-11-22(12-16-25)14-18-28-30-20-24(9-4-2)21-31-28/h11-13,15-17,19,24,28H,3-10,14,18,20-21H2,1-2H3