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

Systemtic Name: (4-hexoxyphenyl) 4-(5-ethyl-1,3-dioxan-2-yl)-3-fluoranyl-benzoate Openeye Name: (4-hexoxyphenyl) 4-(5-ethyl-1,3-dioxan-2-yl)-3-fluoro-benzoate CAS Name: 4-(5-ethyl-1,3-dioxan-2-yl)-3-fluorobenzoic acid (4-hexoxyphenyl) ester IUPAC Name: (4-hexoxyphenyl) 4-(5-ethyl-1,3-dioxan-2-yl)-3-fluorobenzoate Traditional Name: 4-(5-ethyl-1,3-dioxan-2-yl)-3-fluoro-benzoic acid (4-hexoxyphenyl) ester Formula: C25H31FO5 MolecularWeight: 430.509043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31FO5/c1-3-5-6-7-14-28-20-9-11-21(12-10-20)31-24(27)19-8-13-22(23(26)15-19)25-29-16-18(4-2)17-30-25/h8-13,15,18,25H,3-7,14,16-17H2,1-2H3