[4-[(E)-4-cyano-4-fluoranyl-but-3-enyl]cyclohexyl] 4-fluoranylbenzoate

Systemtic Name: [4-[(E)-4-cyano-4-fluoranyl-but-3-enyl]cyclohexyl] 4-fluoranylbenzoate Openeye Name: [4-[(E)-4-cyano-4-fluoro-but-3-enyl]cyclohexyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[(E)-4-cyano-4-fluorobut-3-enyl]cyclohexyl] ester IUPAC Name: [4-[(E)-4-cyano-4-fluorobut-3-enyl]cyclohexyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[(E)-4-cyano-4-fluoro-but-3-enyl]cyclohexyl] ester Formula: C18H19F2NO2 MolecularWeight: 319.345766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19F2NO2/c19-15-8-6-14(7-9-15)18(22)23-17-10-4-13(5-11-17)2-1-3-16(20)12-21/h3,6-9,13,17H,1-2,4-5,10-11H2/b16-3+