2-[4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazol-3-yl]ethanoate

Systemtic Name: 2-[4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazol-3-yl]ethanoate Openeye Name: 2-[4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazol-3-yl]acetate CAS Name: 2-[4-(1-benzotriazolylmethylamino)-1,2,5-oxadiazol-3-yl]acetate IUPAC Name: 2-[4-(benzotriazol-1-ylmethylamino)-1,2,5-oxadiazol-3-yl]acetate Traditional Name: 2-[4-(benzotriazol-1-ylmethylamino)furazan-3-yl]acetate Formula: C11H9N6O3- MolecularWeight: 273.22756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC3=NON=C3CC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC3=NON=C3CC(=O)[O-]

InChI

InChI=1S/C11H10N6O3/c18-10(19)5-8-11(15-20-14-8)12-6-17-9-4-2-1-3-7(9)13-16-17/h1-4H,5-6H2,(H,12,15)(H,18,19)/p-1