4-(3-azaniumylpropyl)-1,2,5-oxadiazole-3-carboxylate

Systemtic Name: 4-(3-azaniumylpropyl)-1,2,5-oxadiazole-3-carboxylate Openeye Name: 4-(3-azaniumylpropyl)-1,2,5-oxadiazole-3-carboxylate CAS Name: 4-(3-ammoniopropyl)-1,2,5-oxadiazole-3-carboxylate IUPAC Name: 4-(3-azaniumylpropyl)-1,2,5-oxadiazole-3-carboxylate Traditional Name: 4-(3-ammoniopropyl)furazan-3-carboxylate Formula: C6H9N3O3 MolecularWeight: 171.15396

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Descriptors Computed from Structure

Canonical SMILES:

C(CC1=NON=C1C(=O)[O-])C[NH3+]

Isomeric SMILES

C(CC1=NON=C1C(=O)[O-])C[NH3+]

InChI

InChI=1S/C6H9N3O3/c7-3-1-2-4-5(6(10)11)9-12-8-4/h1-3,7H2,(H,10,11)