(2,3-dicyano-4-pentyl-phenyl) 4-pentylcyclohexane-1-carboxylate

Systemtic Name: (2,3-dicyano-4-pentyl-phenyl) 4-pentylcyclohexane-1-carboxylate Openeye Name: (2,3-dicyano-4-pentyl-phenyl) 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid (2,3-dicyano-4-pentylphenyl) ester IUPAC Name: (2,3-dicyano-4-pentylphenyl) 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid (4-amyl-2,3-dicyano-phenyl) ester Formula: C25H34N2O2 MolecularWeight: 394.54966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)CCCCC)C#N)C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)CCCCC)C#N)C#N

InChI

InChI=1S/C25H34N2O2/c1-3-5-7-9-19-11-13-21(14-12-19)25(28)29-24-16-15-20(10-8-6-4-2)22(17-26)23(24)18-27/h15-16,19,21H,3-14H2,1-2H3