[4-(3-fluoranylheptoxy)phenyl] 4-octoxybenzoate

Systemtic Name: [4-(3-fluoranylheptoxy)phenyl] 4-octoxybenzoate Openeye Name: [4-(3-fluoroheptoxy)phenyl] 4-octoxybenzoate CAS Name: 4-octoxybenzoic acid [4-(3-fluoroheptoxy)phenyl] ester IUPAC Name: [4-(3-fluoroheptoxy)phenyl] 4-octoxybenzoate Traditional Name: 4-octoxybenzoic acid [4-(3-fluoroheptoxy)phenyl] ester Formula: C28H39FO4 MolecularWeight: 458.605263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCC(CCCC)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OCCC(CCCC)F

InChI

InChI=1S/C28H39FO4/c1-3-5-7-8-9-10-21-31-25-14-12-23(13-15-25)28(30)33-27-18-16-26(17-19-27)32-22-20-24(29)11-6-4-2/h12-19,24H,3-11,20-22H2,1-2H3