methyl 5-(cyanomethyl)-2H-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-(cyanomethyl)-2H-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-(cyanomethyl)-2H-triazole-4-carboxylate CAS Name: 5-(cyanomethyl)-2H-triazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(cyanomethyl)-2H-triazole-4-carboxylate Traditional Name: 5-(cyanomethyl)-2H-triazole-4-carboxylic acid methyl ester Formula: C6H6N4O2 MolecularWeight: 166.13744

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNN=C1CC#N

Isomeric SMILES

COC(=O)C1=NNN=C1CC#N

InChI

InChI=1S/C6H6N4O2/c1-12-6(11)5-4(2-3-7)8-10-9-5/h2H2,1H3,(H,8,9,10)