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

Systemtic Name: (4-butoxyphenyl) 3-fluoranyl-4-(5-heptyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-butoxyphenyl) 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-butoxyphenyl) ester IUPAC Name: (4-butoxyphenyl) 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-butoxyphenyl) ester Formula: C28H37FO5 MolecularWeight: 472.588783

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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)OCCCC)F

Isomeric SMILES

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

InChI

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