2-(5-azanyl-3-nitro-1,2,4-triazol-1-yl)ethanoic acid

Systemtic Name: 2-(5-azanyl-3-nitro-1,2,4-triazol-1-yl)ethanoic acid Openeye Name: 2-(5-amino-3-nitro-1,2,4-triazol-1-yl)acetic acid CAS Name: 2-(5-amino-3-nitro-1,2,4-triazol-1-yl)acetic acid IUPAC Name: 2-(5-amino-3-nitro-1,2,4-triazol-1-yl)acetic acid Traditional Name: 2-(5-amino-3-nitro-1,2,4-triazol-1-yl)acetic acid Formula: C4H5N5O4 MolecularWeight: 187.1136

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)O)N1C(=NC(=N1)[N+](=O)[O-])N

Isomeric SMILES

C(C(=O)O)N1C(=NC(=N1)[N+](=O)[O-])N

InChI

InChI=1S/C4H5N5O4/c5-3-6-4(9(12)13)7-8(3)1-2(10)11/h1H2,(H,10,11)(H2,5,6,7)