[4-(4-cyanophenyl)phenyl] 4-(4-pentylphenyl)benzoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 4-(4-pentylphenyl)benzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 4-(4-pentylphenyl)benzoate CAS Name: 4-(4-pentylphenyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 4-(4-pentylphenyl)benzoate Traditional Name: 4-(4-amylphenyl)benzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C31H27NO2 MolecularWeight: 445.55158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C31H27NO2/c1-2-3-4-5-23-6-10-25(11-7-23)27-14-16-29(17-15-27)31(33)34-30-20-18-28(19-21-30)26-12-8-24(22-32)9-13-26/h6-21H,2-5H2,1H3