4-(3-azanylpropyl)-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxylic acid

Systemtic Name: 4-(3-azanylpropyl)-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxylic acid Openeye Name: 4-(3-aminopropyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxylic acid CAS Name: 4-(3-aminopropyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxylic acid IUPAC Name: 4-(3-aminopropyl)-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxylic acid Traditional Name: 4-(3-aminopropyl)-5-oxido-furazan-5-ium-3-carboxylic acid Formula: C6H9N3O4 MolecularWeight: 187.15336

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Descriptors Computed from Structure

Canonical SMILES:

C(CC1=[N+](ON=C1C(=O)O)[O-])CN

Isomeric SMILES

C(CC1=[N+](ON=C1C(=O)O)[O-])CN

InChI

InChI=1S/C6H9N3O4/c7-3-1-2-4-5(6(10)11)8-13-9(4)12/h1-3,7H2,(H,10,11)