[4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-fluorophenyl)cyclohexane-1-carboxylate

Systemtic Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-fluorophenyl)cyclohexane-1-carboxylate Openeye Name: [4-[(E)-2-cyanovinyl]cyclohexyl] 4-(4-fluorophenyl)cyclohexanecarboxylate CAS Name: 4-(4-fluorophenyl)-1-cyclohexanecarboxylic acid [4-[(E)-2-cyanoethenyl]cyclohexyl] ester IUPAC Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-fluorophenyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-fluorophenyl)cyclohexanecarboxylic acid [4-[(E)-2-cyanovinyl]cyclohexyl] ester Formula: C22H26FNO2 MolecularWeight: 355.445743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26FNO2/c23-20-11-9-18(10-12-20)17-5-7-19(8-6-17)22(25)26-21-13-3-16(4-14-21)2-1-15-24/h1-2,9-12,16-17,19,21H,3-8,13-14H2/b2-1+