1-(4-nitro-1,2,3-triazol-2-yl)propan-2-one

Systemtic Name: 1-(4-nitro-1,2,3-triazol-2-yl)propan-2-one Openeye Name: 1-(4-nitrotriazol-2-yl)propan-2-one CAS Name: 1-(4-nitro-2-triazolyl)-2-propanone IUPAC Name: 1-(4-nitrotriazol-2-yl)propan-2-one Traditional Name: 1-(4-nitrotriazol-2-yl)acetone Formula: C5H6N4O3 MolecularWeight: 170.12614

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1N=CC(=N1)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CN1N=CC(=N1)[N+](=O)[O-]

InChI

InChI=1S/C5H6N4O3/c1-4(10)3-8-6-2-5(7-8)9(11)12/h2H,3H2,1H3