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

Systemtic Name: 2-[3-fluoranyl-4-(4-pentylphenyl)phenyl]-5-pentyl-1,3-dioxane Openeye Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-pentyl-1,3-dioxane CAS Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-pentyl-1,3-dioxane IUPAC Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-pentyl-1,3-dioxane Traditional Name: 5-amyl-2-[4-(4-amylphenyl)-3-fluoro-phenyl]-1,3-dioxane Formula: C26H35FO2 MolecularWeight: 398.553303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2=CC(=C(C=C2)C3=CC=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCC1COC(OC1)C2=CC(=C(C=C2)C3=CC=C(C=C3)CCCCC)F

InChI

InChI=1S/C26H35FO2/c1-3-5-7-9-20-11-13-22(14-12-20)24-16-15-23(17-25(24)27)26-28-18-21(19-29-26)10-8-6-4-2/h11-17,21,26H,3-10,18-19H2,1-2H3