[4-(4-cyano-3-fluoranyl-phenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoranyl-ethenyl]cyclohexane-1-carboxylate

Systemtic Name: [4-(4-cyano-3-fluoranyl-phenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoranyl-ethenyl]cyclohexane-1-carboxylate Openeye Name: [4-(4-cyano-3-fluoro-phenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoro-vinyl]cyclohexanecarboxylate CAS Name: 4-[(E)-2-cyano-2-fluoroethenyl]-1-cyclohexanecarboxylic acid [4-(4-cyano-3-fluorophenyl)cyclohexyl] ester IUPAC Name: [4-(4-cyano-3-fluorophenyl)cyclohexyl] 4-[(E)-2-cyano-2-fluoroethenyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-2-cyano-2-fluoro-vinyl]cyclohexanecarboxylic acid [4-(4-cyano-3-fluoro-phenyl)cyclohexyl] ester Formula: C23H24F2N2O2 MolecularWeight: 398.445666

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C23H24F2N2O2/c24-20(14-27)11-15-1-3-17(4-2-15)23(28)29-21-9-7-16(8-10-21)18-5-6-19(13-26)22(25)12-18/h5-6,11-12,15-17,21H,1-4,7-10H2/b20-11+