(4-cyanophenyl) 4-[(E)-4-cyano-4-fluoranyl-but-3-enyl]cyclohexane-1-carboxylate

Systemtic Name: (4-cyanophenyl) 4-[(E)-4-cyano-4-fluoranyl-but-3-enyl]cyclohexane-1-carboxylate Openeye Name: (4-cyanophenyl) 4-[(E)-4-cyano-4-fluoro-but-3-enyl]cyclohexanecarboxylate CAS Name: 4-[(E)-4-cyano-4-fluorobut-3-enyl]-1-cyclohexanecarboxylic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-[(E)-4-cyano-4-fluorobut-3-enyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-4-cyano-4-fluoro-but-3-enyl]cyclohexanecarboxylic acid (4-cyanophenyl) ester Formula: C19H19FN2O2 MolecularWeight: 326.364763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCC=C(C#N)F)C(=O)OC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CC(CCC1CC/C=C(\C#N)/F)C(=O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19FN2O2/c20-17(13-22)3-1-2-14-4-8-16(9-5-14)19(23)24-18-10-6-15(12-21)7-11-18/h3,6-7,10-11,14,16H,1-2,4-5,8-9H2/b17-3+