hexyl 3-fluoranyl-4-(5-propyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: hexyl 3-fluoranyl-4-(5-propyl-1,3-dioxan-2-yl)benzoate Openeye Name: hexyl 3-fluoro-4-(5-propyl-1,3-dioxan-2-yl)benzoate CAS Name: 3-fluoro-4-(5-propyl-1,3-dioxan-2-yl)benzoic acid hexyl ester IUPAC Name: hexyl 3-fluoro-4-(5-propyl-1,3-dioxan-2-yl)benzoate Traditional Name: 3-fluoro-4-(5-propyl-1,3-dioxan-2-yl)benzoic acid hexyl ester Formula: C20H29FO4 MolecularWeight: 352.440263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC(=C(C=C1)C2OCC(CO2)CCC)F

Isomeric SMILES

CCCCCCOC(=O)C1=CC(=C(C=C1)C2OCC(CO2)CCC)F

InChI

InChI=1S/C20H29FO4/c1-3-5-6-7-11-23-19(22)16-9-10-17(18(21)12-16)20-24-13-15(8-4-2)14-25-20/h9-10,12,15,20H,3-8,11,13-14H2,1-2H3