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

Systemtic Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-butylcyclohexane-1-carboxylate Openeye Name: [4-[(E)-2-cyanovinyl]cyclohexyl] 4-butylcyclohexanecarboxylate CAS Name: 4-butyl-1-cyclohexanecarboxylic acid [4-[(E)-2-cyanoethenyl]cyclohexyl] ester IUPAC Name: [4-[(E)-2-cyanoethenyl]cyclohexyl] 4-butylcyclohexane-1-carboxylate Traditional Name: 4-butylcyclohexanecarboxylic acid [4-[(E)-2-cyanovinyl]cyclohexyl] ester Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)OC2CCC(CC2)C=CC#N

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)OC2CCC(CC2)/C=C/C#N

InChI

InChI=1S/C20H31NO2/c1-2-3-5-16-7-11-18(12-8-16)20(22)23-19-13-9-17(10-14-19)6-4-15-21/h4,6,16-19H,2-3,5,7-14H2,1H3/b6-4+