(4-cyanophenyl) 3-fluoranyl-2-pentyl-benzoate

Systemtic Name: (4-cyanophenyl) 3-fluoranyl-2-pentyl-benzoate Openeye Name: (4-cyanophenyl) 3-fluoro-2-pentyl-benzoate CAS Name: 3-fluoro-2-pentylbenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 3-fluoro-2-pentylbenzoate Traditional Name: 2-amyl-3-fluoro-benzoic acid (4-cyanophenyl) ester Formula: C19H18FNO2 MolecularWeight: 311.350123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=CC=C1F)C(=O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCC1=C(C=CC=C1F)C(=O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H18FNO2/c1-2-3-4-6-16-17(7-5-8-18(16)20)19(22)23-15-11-9-14(13-21)10-12-15/h5,7-12H,2-4,6H2,1H3