(4-cyano-3-fluoranyl-phenyl) 2-fluoranyl-4-(2-fluoranyl-4-propyl-phenyl)benzoate

Systemtic Name: (4-cyano-3-fluoranyl-phenyl) 2-fluoranyl-4-(2-fluoranyl-4-propyl-phenyl)benzoate Openeye Name: (4-cyano-3-fluoro-phenyl) 2-fluoro-4-(2-fluoro-4-propyl-phenyl)benzoate CAS Name: 2-fluoro-4-(2-fluoro-4-propylphenyl)benzoic acid (4-cyano-3-fluorophenyl) ester IUPAC Name: (4-cyano-3-fluorophenyl) 2-fluoro-4-(2-fluoro-4-propylphenyl)benzoate Traditional Name: 2-fluoro-4-(2-fluoro-4-propyl-phenyl)benzoic acid (4-cyano-3-fluoro-phenyl) ester Formula: C23H16F3NO2 MolecularWeight: 395.37385

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F)F)F

Isomeric SMILES

CCCC1=CC(=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC(=C(C=C3)C#N)F)F)F

InChI

InChI=1S/C23H16F3NO2/c1-2-3-14-4-8-18(21(25)10-14)15-6-9-19(22(26)11-15)23(28)29-17-7-5-16(13-27)20(24)12-17/h4-12H,2-3H2,1H3