methyl 4,5-diphenyl-1,2,4-triazole-3-carboxylate

Systemtic Name: methyl 4,5-diphenyl-1,2,4-triazole-3-carboxylate Openeye Name: methyl 4,5-diphenyl-1,2,4-triazole-3-carboxylate CAS Name: 4,5-diphenyl-1,2,4-triazole-3-carboxylic acid methyl ester IUPAC Name: methyl 4,5-diphenyl-1,2,4-triazole-3-carboxylate Traditional Name: 4,5-diphenyl-1,2,4-triazole-3-carboxylic acid methyl ester Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H13N3O2/c1-21-16(20)15-18-17-14(12-8-4-2-5-9-12)19(15)13-10-6-3-7-11-13/h2-11H,1H3