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

Systemtic Name: cyanomethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate Openeye Name: cyanomethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate CAS Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 1,5-diphenyl-1,2,4-triazole-3-carboxylate Traditional Name: 1,5-diphenyl-1,2,4-triazole-3-carboxylic acid cyanomethyl ester Formula: C17H12N4O2 MolecularWeight: 304.30278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC=C3)C(=O)OCC#N

InChI

InChI=1S/C17H12N4O2/c18-11-12-23-17(22)15-19-16(13-7-3-1-4-8-13)21(20-15)14-9-5-2-6-10-14/h1-10H,12H2