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

Systemtic Name: 2-[2-[4-(2-fluoranyl-4-heptyl-phenyl)phenyl]ethyl]-5-pentyl-1,3-dioxane Openeye Name: 2-[2-[4-(2-fluoro-4-heptyl-phenyl)phenyl]ethyl]-5-pentyl-1,3-dioxane CAS Name: 2-[2-[4-(2-fluoro-4-heptylphenyl)phenyl]ethyl]-5-pentyl-1,3-dioxane IUPAC Name: 2-[2-[4-(2-fluoro-4-heptylphenyl)phenyl]ethyl]-5-pentyl-1,3-dioxane Traditional Name: 5-amyl-2-[2-[4-(2-fluoro-4-heptyl-phenyl)phenyl]ethyl]-1,3-dioxane Formula: C30H43FO2 MolecularWeight: 454.659623

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H43FO2/c1-3-5-7-8-10-11-25-15-19-28(29(31)21-25)27-17-13-24(14-18-27)16-20-30-32-22-26(23-33-30)12-9-6-4-2/h13-15,17-19,21,26,30H,3-12,16,20,22-23H2,1-2H3