phenyl 1-(4-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: phenyl 1-(4-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxylate Openeye Name: phenyl 5-phenyl-1-(p-tolyl)-1,2,4-triazole-3-carboxylate CAS Name: 1-(4-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxylic acid phenyl ester IUPAC Name: phenyl 1-(4-methylphenyl)-5-phenyl-1,2,4-triazole-3-carboxylate Traditional Name: 5-phenyl-1-(p-tolyl)-1,2,4-triazole-3-carboxylic acid phenyl ester Formula: C22H17N3O2 MolecularWeight: 355.38928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)OC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)OC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2/c1-16-12-14-18(15-13-16)25-21(17-8-4-2-5-9-17)23-20(24-25)22(26)27-19-10-6-3-7-11-19/h2-15H,1H3