[4-cyano-2,3-bis(fluoranyl)phenyl] 4-ethylcyclohexane-1-carboxylate

Systemtic Name: [4-cyano-2,3-bis(fluoranyl)phenyl] 4-ethylcyclohexane-1-carboxylate Openeye Name: (4-cyano-2,3-difluoro-phenyl) 4-ethylcyclohexanecarboxylate CAS Name: 4-ethyl-1-cyclohexanecarboxylic acid (4-cyano-2,3-difluorophenyl) ester IUPAC Name: (4-cyano-2,3-difluorophenyl) 4-ethylcyclohexane-1-carboxylate Traditional Name: 4-ethylcyclohexanecarboxylic acid (4-cyano-2,3-difluoro-phenyl) ester Formula: C16H17F2NO2 MolecularWeight: 293.308486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)C#N)F)F

Isomeric SMILES

CCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)C#N)F)F

InChI

InChI=1S/C16H17F2NO2/c1-2-10-3-5-11(6-4-10)16(20)21-13-8-7-12(9-19)14(17)15(13)18/h7-8,10-11H,2-6H2,1H3