4-[[4-[(3E,5E)-6-cyano-6-fluoranyl-hexa-3,5-dienyl]cyclohexyl]oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(3E,5E)-6-cyano-6-fluoranyl-hexa-3,5-dienyl]cyclohexyl]oxymethyl]benzenecarbonitrile Openeye Name: 4-[[4-[(3E,5E)-6-cyano-6-fluoro-hexa-3,5-dienyl]cyclohexoxy]methyl]benzonitrile CAS Name: 4-[[4-[(3E,5E)-6-cyano-6-fluorohexa-3,5-dienyl]cyclohexyl]oxymethyl]benzonitrile IUPAC Name: 4-[[4-[(3E,5E)-6-cyano-6-fluorohexa-3,5-dienyl]cyclohexyl]oxymethyl]benzonitrile Traditional Name: 4-[[4-[(3E,5E)-6-cyano-6-fluoro-hexa-3,5-dienyl]cyclohexoxy]methyl]benzonitrile Formula: C21H23FN2O MolecularWeight: 338.418523

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCC=CC=C(C#N)F)OCC2=CC=C(C=C2)C#N

Isomeric SMILES

C1CC(CCC1CC/C=C/C=C(\C#N)/F)OCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H23FN2O/c22-20(15-24)5-3-1-2-4-17-10-12-21(13-11-17)25-16-19-8-6-18(14-23)7-9-19/h1,3,5-9,17,21H,2,4,10-13,16H2/b3-1+,20-5+