methyl 5-azanyl-1-(3-cyanophenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-(3-cyanophenyl)-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-amino-1-(3-cyanophenyl)triazole-4-carboxylate CAS Name: 5-amino-1-(3-cyanophenyl)-4-triazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-(3-cyanophenyl)triazole-4-carboxylate Traditional Name: 5-amino-1-(3-cyanophenyl)triazole-4-carboxylic acid methyl ester Formula: C11H9N5O2 MolecularWeight: 243.22146

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)C2=CC=CC(=C2)C#N)N

Isomeric SMILES

COC(=O)C1=C(N(N=N1)C2=CC=CC(=C2)C#N)N

InChI

InChI=1S/C11H9N5O2/c1-18-11(17)9-10(13)16(15-14-9)8-4-2-3-7(5-8)6-12/h2-5H,13H2,1H3