(4-pentoxyphenyl) 3-fluoranyl-4-(5-heptyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: (4-pentoxyphenyl) 3-fluoranyl-4-(5-heptyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-pentoxyphenyl) 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzoate CAS Name: 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzoic acid (4-pentoxyphenyl) ester IUPAC Name: (4-pentoxyphenyl) 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzoate Traditional Name: 3-fluoro-4-(5-heptyl-1,3-dioxan-2-yl)benzoic acid (4-amoxyphenyl) ester Formula: C29H39FO5 MolecularWeight: 486.615363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCC)F

Isomeric SMILES

CCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCC)F

InChI

InChI=1S/C29H39FO5/c1-3-5-7-8-9-11-22-20-33-29(34-21-22)26-17-12-23(19-27(26)30)28(31)35-25-15-13-24(14-16-25)32-18-10-6-4-2/h12-17,19,22,29H,3-11,18,20-21H2,1-2H3