4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazole-3-carboxylate

Systemtic Name: 4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazole-3-carboxylate Openeye Name: 4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazole-3-carboxylate CAS Name: 4-(1-benzotriazolylmethylamino)-1,2,5-oxadiazole-3-carboxylate IUPAC Name: 4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazole-3-carboxylate Traditional Name: 4-(benzotriazol-1-ylmethylamino)furazan-3-carboxylate Formula: C10H7N6O3- MolecularWeight: 259.20098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC3=NON=C3C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC3=NON=C3C(=O)[O-]

InChI

InChI=1S/C10H8N6O3/c17-10(18)8-9(14-19-13-8)11-5-16-7-4-2-1-3-6(7)12-15-16/h1-4H,5H2,(H,11,14)(H,17,18)/p-1