(4-fluorophenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate

Systemtic Name: (4-fluorophenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate Openeye Name: (4-fluorophenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexanecarboxylate CAS Name: 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]-1-cyclohexanecarboxylic acid (4-fluorophenyl) ester IUPAC Name: (4-fluorophenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate Traditional Name: 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexanecarboxylic acid (4-fluorophenyl) ester Formula: C20H22FNO2 MolecularWeight: 327.392583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22FNO2/c21-18-11-13-19(14-12-18)24-20(23)17-9-7-16(8-10-17)6-4-2-1-3-5-15-22/h1-3,5,11-14,16-17H,4,6-10H2/b2-1+,5-3+