methyl 5-(trinitromethyl)-2H-1,2,3-triazole-4-carboxylate

Systemtic Name: methyl 5-(trinitromethyl)-2H-1,2,3-triazole-4-carboxylate Openeye Name: methyl 5-(trinitromethyl)-2H-triazole-4-carboxylate CAS Name: 5-(trinitromethyl)-2H-triazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(trinitromethyl)-2H-triazole-4-carboxylate Traditional Name: 5-(trinitromethyl)-2H-triazole-4-carboxylic acid methyl ester Formula: C5H4N6O8 MolecularWeight: 276.12066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NNN=C1C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=NNN=C1C([N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C5H4N6O8/c1-19-4(12)2-3(7-8-6-2)5(9(13)14,10(15)16)11(17)18/h1H3,(H,6,7,8)