[4-(4-cyanophenyl)phenyl] 4-(1-heptylcyclohexyl)benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-(1-heptylcyclohexyl)benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-(1-heptylcyclohexyl)benzoate CAS Name: 4-(1-heptylcyclohexyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-(1-heptylcyclohexyl)benzoate Traditional Name: 4-(1-heptylcyclohexyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C33H37NO2 MolecularWeight: 479.65238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(CCCCC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCCCCCC1(CCCCC1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C33H37NO2/c1-2-3-4-5-7-22-33(23-8-6-9-24-33)30-18-14-29(15-19-30)32(35)36-31-20-16-28(17-21-31)27-12-10-26(25-34)11-13-27/h10-21H,2-9,22-24H2,1H3