[2-(2-fluoranylheptyl)phenyl] 4-(3-fluoranyl-4-octoxy-phenyl)benzoate

Systemtic Name: [2-(2-fluoranylheptyl)phenyl] 4-(3-fluoranyl-4-octoxy-phenyl)benzoate Openeye Name: [2-(2-fluoroheptyl)phenyl] 4-(3-fluoro-4-octoxy-phenyl)benzoate CAS Name: 4-(3-fluoro-4-octoxyphenyl)benzoic acid [2-(2-fluoroheptyl)phenyl] ester IUPAC Name: [2-(2-fluoroheptyl)phenyl] 4-(3-fluoro-4-octoxyphenyl)benzoate Traditional Name: 4-(3-fluoro-4-octoxy-phenyl)benzoic acid [2-(2-fluoroheptyl)phenyl] ester Formula: C34H42F2O3 MolecularWeight: 536.692286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CC(CCCCC)F)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=CC=C3CC(CCCCC)F)F

InChI

InChI=1S/C34H42F2O3/c1-3-5-7-8-9-13-23-38-33-22-21-28(25-31(33)36)26-17-19-27(20-18-26)34(37)39-32-16-12-11-14-29(32)24-30(35)15-10-6-4-2/h11-12,14,16-22,25,30H,3-10,13,15,23-24H2,1-2H3