(4-heptoxyphenyl) 3-fluoranyl-4-(5-octyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: (4-heptoxyphenyl) 3-fluoranyl-4-(5-octyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-heptoxyphenyl) 3-fluoro-4-(5-octyl-1,3-dioxan-2-yl)benzoate CAS Name: 3-fluoro-4-(5-octyl-1,3-dioxan-2-yl)benzoic acid (4-heptoxyphenyl) ester IUPAC Name: (4-heptoxyphenyl) 3-fluoro-4-(5-octyl-1,3-dioxan-2-yl)benzoate Traditional Name: 3-fluoro-4-(5-octyl-1,3-dioxan-2-yl)benzoic acid (4-heptoxyphenyl) ester Formula: C32H45FO5 MolecularWeight: 528.695103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCCC)F

Isomeric SMILES

CCCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCCCC)F

InChI

InChI=1S/C32H45FO5/c1-3-5-7-9-10-12-14-25-23-36-32(37-24-25)29-20-15-26(22-30(29)33)31(34)38-28-18-16-27(17-19-28)35-21-13-11-8-6-4-2/h15-20,22,25,32H,3-14,21,23-24H2,1-2H3