methyl 3-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)amino]propanoate

Systemtic Name: methyl 3-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)amino]propanoate Openeye Name: methyl 3-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)amino]propanoate CAS Name: 3-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)amino]propanoate Traditional Name: 3-[(2-methyl-5-nitro-1,2,4-triazol-3-yl)amino]propionic acid methyl ester Formula: C7H11N5O4 MolecularWeight: 229.19334

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])NCCC(=O)OC

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])NCCC(=O)OC

InChI

InChI=1S/C7H11N5O4/c1-11-6(8-4-3-5(13)16-2)9-7(10-11)12(14)15/h3-4H2,1-2H3,(H,8,9,10)