[4-(4-methylphenyl)phenyl] 3-cyanobenzoate

Systemtic Name: [4-(4-methylphenyl)phenyl] 3-cyanobenzoate Openeye Name: [4-(p-tolyl)phenyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [4-(4-methylphenyl)phenyl] ester IUPAC Name: [4-(4-methylphenyl)phenyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [4-(p-tolyl)phenyl] ester Formula: C21H15NO2 MolecularWeight: 313.3493

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15NO2/c1-15-5-7-17(8-6-15)18-9-11-20(12-10-18)24-21(23)19-4-2-3-16(13-19)14-22/h2-13H,1H3