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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCC)F

Isomeric SMILES

CCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCC)F

InChI

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