(4-cyano-3-fluoranyl-phenyl) 4-[(E)-but-2-enyl]benzoate

Systemtic Name: (4-cyano-3-fluoranyl-phenyl) 4-[(E)-but-2-enyl]benzoate Openeye Name: (4-cyano-3-fluoro-phenyl) 4-[(E)-but-2-enyl]benzoate CAS Name: 4-[(E)-but-2-enyl]benzoic acid (4-cyano-3-fluorophenyl) ester IUPAC Name: (4-cyano-3-fluorophenyl) 4-[(E)-but-2-enyl]benzoate Traditional Name: 4-[(E)-but-2-enyl]benzoic acid (4-cyano-3-fluoro-phenyl) ester Formula: C18H14FNO2 MolecularWeight: 295.307663

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F

Isomeric SMILES

C/C=C/CC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C#N)F

InChI

InChI=1S/C18H14FNO2/c1-2-3-4-13-5-7-14(8-6-13)18(21)22-16-10-9-15(12-20)17(19)11-16/h2-3,5-11H,4H2,1H3/b3-2+