(2-cyano-4-methyl-phenyl) 1-(4-methylphenyl)cyclohexane-1-carboxylate

Systemtic Name: (2-cyano-4-methyl-phenyl) 1-(4-methylphenyl)cyclohexane-1-carboxylate Openeye Name: (2-cyano-4-methyl-phenyl) 1-(p-tolyl)cyclohexanecarboxylate CAS Name: 1-(4-methylphenyl)-1-cyclohexanecarboxylic acid (2-cyano-4-methylphenyl) ester IUPAC Name: (2-cyano-4-methylphenyl) 1-(4-methylphenyl)cyclohexane-1-carboxylate Traditional Name: 1-(p-tolyl)cyclohexanecarboxylic acid (2-cyano-4-methyl-phenyl) ester Formula: C22H23NO2 MolecularWeight: 333.42352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)C)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2(CCCCC2)C(=O)OC3=C(C=C(C=C3)C)C#N

InChI

InChI=1S/C22H23NO2/c1-16-6-9-19(10-7-16)22(12-4-3-5-13-22)21(24)25-20-11-8-17(2)14-18(20)15-23/h6-11,14H,3-5,12-13H2,1-2H3