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

Systemtic Name: 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(4-bromophenyl)-1,2,3-triazole-4-carboxylate Openeye Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-bromophenyl)triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-bromophenyl)-4-triazolecarboxylate IUPAC Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-bromophenyl)triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-(4-bromophenyl)triazole-4-carboxylate Formula: C11H6BrN6O3- MolecularWeight: 350.10774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(N=NN2C3=NON=C3N)C(=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1C2=C(N=NN2C3=NON=C3N)C(=O)[O-])Br

InChI

InChI=1S/C11H7BrN6O3/c12-6-3-1-5(2-4-6)8-7(11(19)20)14-17-18(8)10-9(13)15-21-16-10/h1-4H,(H2,13,15)(H,19,20)/p-1