[3,4-bis(fluoranyl)phenyl] 4-[(E)-4-cyanobut-3-enyl]cyclohexane-1-carboxylate

Systemtic Name: [3,4-bis(fluoranyl)phenyl] 4-[(E)-4-cyanobut-3-enyl]cyclohexane-1-carboxylate Openeye Name: (3,4-difluorophenyl) 4-[(E)-4-cyanobut-3-enyl]cyclohexanecarboxylate CAS Name: 4-[(E)-4-cyanobut-3-enyl]-1-cyclohexanecarboxylic acid (3,4-difluorophenyl) ester IUPAC Name: (3,4-difluorophenyl) 4-[(E)-4-cyanobut-3-enyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-4-cyanobut-3-enyl]cyclohexanecarboxylic acid (3,4-difluorophenyl) ester Formula: C18H19F2NO2 MolecularWeight: 319.345766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19F2NO2/c19-16-10-9-15(12-17(16)20)23-18(22)14-7-5-13(6-8-14)4-2-1-3-11-21/h1,3,9-10,12-14H,2,4-8H2/b3-1+