[3-cyano-5-fluoranyl-4-(trifluoromethyloxy)phenyl] 4-ethylcyclohexane-1-carboxylate

Systemtic Name: [3-cyano-5-fluoranyl-4-(trifluoromethyloxy)phenyl] 4-ethylcyclohexane-1-carboxylate Openeye Name: [3-cyano-5-fluoro-4-(trifluoromethoxy)phenyl] 4-ethylcyclohexanecarboxylate CAS Name: 4-ethyl-1-cyclohexanecarboxylic acid [3-cyano-5-fluoro-4-(trifluoromethoxy)phenyl] ester IUPAC Name: [3-cyano-5-fluoro-4-(trifluoromethoxy)phenyl] 4-ethylcyclohexane-1-carboxylate Traditional Name: 4-ethylcyclohexanecarboxylic acid [3-cyano-5-fluoro-4-(trifluoromethoxy)phenyl] ester Formula: C17H17F4NO3 MolecularWeight: 359.315393

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17F4NO3/c1-2-10-3-5-11(6-4-10)16(23)24-13-7-12(9-22)15(14(18)8-13)25-17(19,20)21/h7-8,10-11H,2-6H2,1H3