(3-fluoranyl-4-octoxy-phenyl) 4-octoxybenzoate

Systemtic Name: (3-fluoranyl-4-octoxy-phenyl) 4-octoxybenzoate Openeye Name: (3-fluoro-4-octoxy-phenyl) 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid (3-fluoro-4-octoxyphenyl) ester IUPAC Name: (3-fluoro-4-octoxyphenyl) 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid (3-fluoro-4-octoxy-phenyl) ester Formula: C29H41FO4 MolecularWeight: 472.631843

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)OCCCCCCCC)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)OCCCCCCCC)F

InChI

InChI=1S/C29H41FO4/c1-3-5-7-9-11-13-21-32-25-17-15-24(16-18-25)29(31)34-26-19-20-28(27(30)23-26)33-22-14-12-10-8-6-4-2/h15-20,23H,3-14,21-22H2,1-2H3