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

Systemtic Name: (4-butylphenyl) 3-fluoranyl-4-(5-pentyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-butylphenyl) 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-butylphenyl) ester IUPAC Name: (4-butylphenyl) 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-butylphenyl) ester Formula: C26H33FO4 MolecularWeight: 428.536223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCC)F

Isomeric SMILES

CCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)CCCC)F

InChI

InChI=1S/C26H33FO4/c1-3-5-7-9-20-17-29-26(30-18-20)23-15-12-21(16-24(23)27)25(28)31-22-13-10-19(11-14-22)8-6-4-2/h10-16,20,26H,3-9,17-18H2,1-2H3