(4-hexylphenyl) 4-[(E)-4-cyanobut-3-enyl]cyclohexane-1-carboxylate

Systemtic Name: (4-hexylphenyl) 4-[(E)-4-cyanobut-3-enyl]cyclohexane-1-carboxylate Openeye Name: (4-hexylphenyl) 4-[(E)-4-cyanobut-3-enyl]cyclohexanecarboxylate CAS Name: 4-[(E)-4-cyanobut-3-enyl]-1-cyclohexanecarboxylic acid (4-hexylphenyl) ester IUPAC Name: (4-hexylphenyl) 4-[(E)-4-cyanobut-3-enyl]cyclohexane-1-carboxylate Traditional Name: 4-[(E)-4-cyanobut-3-enyl]cyclohexanecarboxylic acid (4-hexylphenyl) ester Formula: C24H33NO2 MolecularWeight: 367.52432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H33NO2/c1-2-3-4-6-9-21-13-17-23(18-14-21)27-24(26)22-15-11-20(12-16-22)10-7-5-8-19-25/h5,8,13-14,17-18,20,22H,2-4,6-7,9-12,15-16H2,1H3/b8-5+