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

Systemtic Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-propylphenyl)cyclohexane-1-carboxylate Openeye Name: [4-[(E)-2-cyanovinyl]cyclohexyl] 4-(4-propylphenyl)cyclohexanecarboxylate CAS Name: 4-(4-propylphenyl)-1-cyclohexanecarboxylic acid [4-[(E)-2-cyanoethenyl]cyclohexyl] ester IUPAC Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-(4-propylphenyl)cyclohexane-1-carboxylate Traditional Name: 4-(4-propylphenyl)cyclohexanecarboxylic acid [4-[(E)-2-cyanovinyl]cyclohexyl] ester Formula: C25H33NO2 MolecularWeight: 379.53502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2CCC(CC2)C(=O)OC3CCC(CC3)C=CC#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C2CCC(CC2)C(=O)OC3CCC(CC3)/C=C/C#N

InChI

InChI=1S/C25H33NO2/c1-2-4-19-6-10-21(11-7-19)22-12-14-23(15-13-22)25(27)28-24-16-8-20(9-17-24)5-3-18-26/h3,5-7,10-11,20,22-24H,2,4,8-9,12-17H2,1H3/b5-3+