ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(2-methylphenyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: ethyl 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(2-methylphenyl)-1,2,3-triazole-4-carboxylate Openeye Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(o-tolyl)triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-methylphenyl)-4-triazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(2-methylphenyl)triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-(o-tolyl)triazole-4-carboxylic acid ethyl ester Formula: C14H14N6O3 MolecularWeight: 314.29936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(N(N=N1)C2=NON=C2N)C3=CC=CC=C3C

InChI

InChI=1S/C14H14N6O3/c1-3-22-14(21)10-11(9-7-5-4-6-8(9)2)20(19-16-10)13-12(15)17-23-18-13/h4-7H,3H2,1-2H3,(H2,15,17)