(4-cyanophenyl) 4-butyl-3-fluoranyl-benzoate

Systemtic Name: (4-cyanophenyl) 4-butyl-3-fluoranyl-benzoate Openeye Name: (4-cyanophenyl) 4-butyl-3-fluoro-benzoate CAS Name: 4-butyl-3-fluorobenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-butyl-3-fluorobenzoate Traditional Name: 4-butyl-3-fluoro-benzoic acid (4-cyanophenyl) ester Formula: C18H16FNO2 MolecularWeight: 297.323543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N)F

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N)F

InChI

InChI=1S/C18H16FNO2/c1-2-3-4-14-7-8-15(11-17(14)19)18(21)22-16-9-5-13(12-20)6-10-16/h5-11H,2-4H2,1H3