1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ium-4-ylmethyl)-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-(4-azanyl-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ium-4-ylmethyl)-1,2,3-triazole-4-carboxylate Openeye Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ium-4-ylmethyl)triazole-4-carboxylate CAS Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(4-morpholin-4-iumylmethyl)-4-triazolecarboxylate IUPAC Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(morpholin-4-ium-4-ylmethyl)triazole-4-carboxylate Traditional Name: 1-(4-aminofurazan-3-yl)-5-(morpholin-4-ium-4-ylmethyl)triazole-4-carboxylate Formula: C10H13N7O4 MolecularWeight: 295.25472

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(N=NN2C3=NON=C3N)C(=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=C(N=NN2C3=NON=C3N)C(=O)[O-]

InChI

InChI=1S/C10H13N7O4/c11-8-9(14-21-13-8)17-6(7(10(18)19)12-15-17)5-16-1-3-20-4-2-16/h1-5H2,(H2,11,13)(H,18,19)