(2-cyano-4-propyl-phenyl) 1-(4-pentylphenyl)cyclohexane-1-carboxylate

Systemtic Name: (2-cyano-4-propyl-phenyl) 1-(4-pentylphenyl)cyclohexane-1-carboxylate Openeye Name: (2-cyano-4-propyl-phenyl) 1-(4-pentylphenyl)cyclohexanecarboxylate CAS Name: 1-(4-pentylphenyl)-1-cyclohexanecarboxylic acid (2-cyano-4-propylphenyl) ester IUPAC Name: (2-cyano-4-propylphenyl) 1-(4-pentylphenyl)cyclohexane-1-carboxylate Traditional Name: 1-(4-amylphenyl)cyclohexanecarboxylic acid (2-cyano-4-propyl-phenyl) ester Formula: C28H35NO2 MolecularWeight: 417.583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)CCC)C#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)CCC)C#N

InChI

InChI=1S/C28H35NO2/c1-3-5-7-11-22-12-15-25(16-13-22)28(18-8-6-9-19-28)27(30)31-26-17-14-23(10-4-2)20-24(26)21-29/h12-17,20H,3-11,18-19H2,1-2H3