(6-cyano-6-fluoranyl-6-phenyl-hexyl) benzoate

Systemtic Name: (6-cyano-6-fluoranyl-6-phenyl-hexyl) benzoate Openeye Name: (6-cyano-6-fluoro-6-phenyl-hexyl) benzoate CAS Name: benzoic acid (6-cyano-6-fluoro-6-phenylhexyl) ester IUPAC Name: (6-cyano-6-fluoro-6-phenylhexyl) benzoate Traditional Name: benzoic acid (6-cyano-6-fluoro-6-phenyl-hexyl) ester Formula: C20H20FNO2 MolecularWeight: 325.376703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OCCCCCC(C#N)(C2=CC=CC=C2)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OCCCCCC(C#N)(C2=CC=CC=C2)F

InChI

InChI=1S/C20H20FNO2/c21-20(16-22,18-12-6-2-7-13-18)14-8-3-9-15-24-19(23)17-10-4-1-5-11-17/h1-2,4-7,10-13H,3,8-9,14-15H2