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

Systemtic Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-cyano-3-fluoranyl-phenyl)cyclohexane-1-carboxylate Openeye Name: [4-[(E)-2-cyanovinyl]cyclohexyl] 4-(4-cyano-3-fluoro-phenyl)cyclohexanecarboxylate CAS Name: 4-(4-cyano-3-fluorophenyl)-1-cyclohexanecarboxylic acid [4-[(E)-2-cyanoethenyl]cyclohexyl] ester IUPAC Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-cyano-3-fluorophenyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-cyano-3-fluoro-phenyl)cyclohexanecarboxylic acid [4-[(E)-2-cyanovinyl]cyclohexyl] ester Formula: C23H25FN2O2 MolecularWeight: 380.455203

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C=CC#N)OC(=O)C2CCC(CC2)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

C1CC(CCC1/C=C/C#N)OC(=O)C2CCC(CC2)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C23H25FN2O2/c24-22-14-19(9-10-20(22)15-26)17-5-7-18(8-6-17)23(27)28-21-11-3-16(4-12-21)2-1-13-25/h1-2,9-10,14,16-18,21H,3-8,11-12H2/b2-1+