(4-cyano-3-fluoranyl-phenyl) 4-pentylbenzoate

Systemtic Name: (4-cyano-3-fluoranyl-phenyl) 4-pentylbenzoate Openeye Name: (4-cyano-3-fluoro-phenyl) 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid (4-cyano-3-fluorophenyl) ester IUPAC Name: (4-cyano-3-fluorophenyl) 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid (4-cyano-3-fluoro-phenyl) ester Formula: C19H18FNO2 MolecularWeight: 311.350123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C19H18FNO2/c1-2-3-4-5-14-6-8-15(9-7-14)19(22)23-17-11-10-16(13-21)18(20)12-17/h6-12H,2-5H2,1H3