[4-(4-cyanophenyl)phenyl] 1,5-diphenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 1,5-diphenyl-1,2,4-triazole-3-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] 1,5-diphenyl-1,2,4-triazole-3-carboxylate CAS Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 1,5-diphenyl-1,2,4-triazole-3-carboxylate Traditional Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C28H18N4O2 MolecularWeight: 442.46812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C28H18N4O2/c29-19-20-11-13-21(14-12-20)22-15-17-25(18-16-22)34-28(33)26-30-27(23-7-3-1-4-8-23)32(31-26)24-9-5-2-6-10-24/h1-18H