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

Systemtic Name: [4-(4-hexoxyphenyl)phenyl] 2-fluoranyl-2-pentyl-1,3-dioxane-5-carboxylate Openeye Name: [4-(4-hexoxyphenyl)phenyl] 2-fluoro-2-pentyl-1,3-dioxane-5-carboxylate CAS Name: 2-fluoro-2-pentyl-1,3-dioxane-5-carboxylic acid [4-(4-hexoxyphenyl)phenyl] ester IUPAC Name: [4-(4-hexoxyphenyl)phenyl] 2-fluoro-2-pentyl-1,3-dioxane-5-carboxylate Traditional Name: 2-amyl-2-fluoro-1,3-dioxane-5-carboxylic acid [4-(4-hexoxyphenyl)phenyl] ester Formula: C28H37FO5 MolecularWeight: 472.588783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3COC(OC3)(CCCCC)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3COC(OC3)(CCCCC)F

InChI

InChI=1S/C28H37FO5/c1-3-5-7-9-19-31-25-14-10-22(11-15-25)23-12-16-26(17-13-23)34-27(30)24-20-32-28(29,33-21-24)18-8-6-4-2/h10-17,24H,3-9,18-21H2,1-2H3