[4-cyano-4-(2-methylbutyl)cyclohexyl] 4-(4-heptylphenyl)benzoate

Systemtic Name: [4-cyano-4-(2-methylbutyl)cyclohexyl] 4-(4-heptylphenyl)benzoate Openeye Name: [4-cyano-4-(2-methylbutyl)cyclohexyl] 4-(4-heptylphenyl)benzoate CAS Name: 4-(4-heptylphenyl)benzoic acid [4-cyano-4-(2-methylbutyl)cyclohexyl] ester IUPAC Name: [4-cyano-4-(2-methylbutyl)cyclohexyl] 4-(4-heptylphenyl)benzoate Traditional Name: 4-(4-heptylphenyl)benzoic acid [4-cyano-4-(2-methylbutyl)cyclohexyl] ester Formula: C32H43NO2 MolecularWeight: 473.68932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)(CC(C)CC)C#N

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)(CC(C)CC)C#N

InChI

InChI=1S/C32H43NO2/c1-4-6-7-8-9-10-26-11-13-27(14-12-26)28-15-17-29(18-16-28)31(34)35-30-19-21-32(24-33,22-20-30)23-25(3)5-2/h11-18,25,30H,4-10,19-23H2,1-3H3