(4-hexoxyphenyl) 3-fluoranyl-4-(5-pentyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: (4-hexoxyphenyl) 3-fluoranyl-4-(5-pentyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-hexoxyphenyl) 3-fluoro-4-(5-pentyl-1,3-dioxan-2-yl)benzoate CAS Name: 3-fluoro-4-(5-pentyl-1,3-dioxan-2-yl)benzoic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 3-fluoro-4-(5-pentyl-1,3-dioxan-2-yl)benzoate Traditional Name: 4-(5-amyl-1,3-dioxan-2-yl)-3-fluoro-benzoic acid (4-hexoxyphenyl) ester Formula: C28H37FO5 MolecularWeight: 472.588783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)C3OCC(CO3)CCCCC)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC(=C(C=C2)C3OCC(CO3)CCCCC)F

InChI

InChI=1S/C28H37FO5/c1-3-5-7-9-17-31-23-12-14-24(15-13-23)34-27(30)22-11-16-25(26(29)18-22)28-32-19-21(20-33-28)10-8-6-4-2/h11-16,18,21,28H,3-10,17,19-20H2,1-2H3