[4-(4-cyanophenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoranyl-ethenyl]cyclohexane-1-carboxylate

Systemtic Name: [4-(4-cyanophenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoranyl-ethenyl]cyclohexane-1-carboxylate Openeye Name: [4-(4-cyanophenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoro-vinyl]cyclohexanecarboxylate CAS Name: 4-[(E)-2-cyano-2-fluoroethenyl]-1-cyclohexanecarboxylic acid [4-(4-cyanophenyl)cyclohexyl] ester IUPAC Name: [4-(4-cyanophenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoroethenyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-2-cyano-2-fluoro-vinyl]cyclohexanecarboxylic acid [4-(4-cyanophenyl)cyclohexyl] ester Formula: C23H25FN2O2 MolecularWeight: 380.455203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C=C(C#N)F)C(=O)OC2CCC(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(CCC1/C=C(\C#N)/F)C(=O)OC2CCC(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H25FN2O2/c24-21(15-26)13-16-1-7-20(8-2-16)23(27)28-22-11-9-19(10-12-22)18-5-3-17(14-25)4-6-18/h3-6,13,16,19-20,22H,1-2,7-12H2/b21-13+