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

Systemtic Name: [4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexyl] 4-(4-hexylphenyl)cyclohexane-1-carboxylate Openeye Name: [4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexyl] 4-(4-hexylphenyl)cyclohexanecarboxylate CAS Name: 4-(4-hexylphenyl)-1-cyclohexanecarboxylic acid [4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexyl] ester IUPAC Name: [4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexyl] 4-(4-hexylphenyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-hexylphenyl)cyclohexanecarboxylic acid [4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexyl] ester Formula: C32H45NO2 MolecularWeight: 475.7052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2CCC(CC2)C(=O)OC3CCC(CC3)CCC=CC=CC#N

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2CCC(CC2)C(=O)OC3CCC(CC3)CC/C=C/C=C/C#N

InChI

InChI=1S/C32H45NO2/c1-2-3-4-8-11-26-13-17-28(18-14-26)29-19-21-30(22-20-29)32(34)35-31-23-15-27(16-24-31)12-9-6-5-7-10-25-33/h5-7,10,13-14,17-18,27,29-31H,2-4,8-9,11-12,15-16,19-24H2,1H3/b6-5+,10-7+