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

Systemtic Name: (4-propylphenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate Openeye Name: (4-propylphenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexanecarboxylate CAS Name: 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]-1-cyclohexanecarboxylic acid (4-propylphenyl) ester IUPAC Name: (4-propylphenyl) 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexane-1-carboxylate Traditional Name: 4-[(3E,5E)-6-cyanohexa-3,5-dienyl]cyclohexanecarboxylic acid (4-propylphenyl) ester Formula: C23H29NO2 MolecularWeight: 351.48186

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OC(=O)C2CCC(CC2)CCC=CC=CC#N

Isomeric SMILES

CCCC1=CC=C(C=C1)OC(=O)C2CCC(CC2)CC/C=C/C=C/C#N

InChI

InChI=1S/C23H29NO2/c1-2-8-19-12-16-22(17-13-19)26-23(25)21-14-10-20(11-15-21)9-6-4-3-5-7-18-24/h3-5,7,12-13,16-17,20-21H,2,6,8-11,14-15H2,1H3/b4-3+,7-5+