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

Systemtic Name: [4-(4-cyanophenyl)phenyl] 3-cyanobenzoate Openeye Name: [4-(4-cyanophenyl)phenyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [4-(4-cyanophenyl)phenyl] ester Formula: C21H12N2O2 MolecularWeight: 324.33218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N)C#N

InChI

InChI=1S/C21H12N2O2/c22-13-15-4-6-17(7-5-15)18-8-10-20(11-9-18)25-21(24)19-3-1-2-16(12-19)14-23/h1-12H