(4-pentoxyphenyl) 3-fluoranyl-4-(5-nonyl-1,3-dioxan-2-yl)benzoate

Systemtic Name: (4-pentoxyphenyl) 3-fluoranyl-4-(5-nonyl-1,3-dioxan-2-yl)benzoate Openeye Name: (4-pentoxyphenyl) 3-fluoro-4-(5-nonyl-1,3-dioxan-2-yl)benzoate CAS Name: 3-fluoro-4-(5-nonyl-1,3-dioxan-2-yl)benzoic acid (4-pentoxyphenyl) ester IUPAC Name: (4-pentoxyphenyl) 3-fluoro-4-(5-nonyl-1,3-dioxan-2-yl)benzoate Traditional Name: 3-fluoro-4-(5-nonyl-1,3-dioxan-2-yl)benzoic acid (4-amoxyphenyl) ester Formula: C31H43FO5 MolecularWeight: 514.668523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCC)F

Isomeric SMILES

CCCCCCCCCC1COC(OC1)C2=C(C=C(C=C2)C(=O)OC3=CC=C(C=C3)OCCCCC)F

InChI

InChI=1S/C31H43FO5/c1-3-5-7-8-9-10-11-13-24-22-35-31(36-23-24)28-19-14-25(21-29(28)32)30(33)37-27-17-15-26(16-18-27)34-20-12-6-4-2/h14-19,21,24,31H,3-13,20,22-23H2,1-2H3