[4-(4-cyanophenyl)cyclohexyl] 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate

Systemtic Name: [4-(4-cyanophenyl)cyclohexyl] 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate Openeye Name: [4-(4-cyanophenyl)cyclohexyl] 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexanecarboxylate CAS Name: 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]-1-cyclohexanecarboxylic acid [4-(4-cyanophenyl)cyclohexyl] ester IUPAC Name: [4-(4-cyanophenyl)cyclohexyl] 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate Traditional Name: 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexanecarboxylic acid [4-(4-cyanophenyl)cyclohexyl] ester Formula: C27H32N2O2 MolecularWeight: 416.55518

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCC=CC=CC#N)C(=O)OC2CCC(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(CCC1CC/C=C/C=C/C#N)C(=O)OC2CCC(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C27H32N2O2/c28-19-5-3-1-2-4-6-21-7-13-25(14-8-21)27(30)31-26-17-15-24(16-18-26)23-11-9-22(20-29)10-12-23/h1-3,5,9-12,21,24-26H,4,6-8,13-18H2/b2-1+,5-3+