4-(3-nitro-1,2,4-triazol-1-yl)butanoic acid

Systemtic Name: 4-(3-nitro-1,2,4-triazol-1-yl)butanoic acid Openeye Name: 4-(3-nitro-1,2,4-triazol-1-yl)butanoic acid CAS Name: 4-(3-nitro-1,2,4-triazol-1-yl)butanoic acid IUPAC Name: 4-(3-nitro-1,2,4-triazol-1-yl)butanoic acid Traditional Name: 4-(3-nitro-1,2,4-triazol-1-yl)butyric acid Formula: C6H8N4O4 MolecularWeight: 200.15212

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=NN1CCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=NC(=NN1CCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C6H8N4O4/c11-5(12)2-1-3-9-4-7-6(8-9)10(13)14/h4H,1-3H2,(H,11,12)