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

Systemtic Name: 2-[2-[4-(4-ethoxyphenyl)-3-fluoranyl-phenyl]ethyl]-5-heptyl-1,3-dioxane Openeye Name: 2-[2-[4-(4-ethoxyphenyl)-3-fluoro-phenyl]ethyl]-5-heptyl-1,3-dioxane CAS Name: 2-[2-[4-(4-ethoxyphenyl)-3-fluorophenyl]ethyl]-5-heptyl-1,3-dioxane IUPAC Name: 2-[2-[4-(4-ethoxyphenyl)-3-fluorophenyl]ethyl]-5-heptyl-1,3-dioxane Traditional Name: 2-[2-(3-fluoro-4-p-phenetyl-phenyl)ethyl]-5-heptyl-1,3-dioxane Formula: C27H37FO3 MolecularWeight: 428.579283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)CCC2=CC(=C(C=C2)C3=CC=C(C=C3)OCC)F

Isomeric SMILES

CCCCCCCC1COC(OC1)CCC2=CC(=C(C=C2)C3=CC=C(C=C3)OCC)F

InChI

InChI=1S/C27H37FO3/c1-3-5-6-7-8-9-22-19-30-27(31-20-22)17-11-21-10-16-25(26(28)18-21)23-12-14-24(15-13-23)29-4-2/h10,12-16,18,22,27H,3-9,11,17,19-20H2,1-2H3