4-[3-nitro-5-(3-nitropyrazol-1-yl)-1,2,4-triazol-1-yl]butan-2-one

Systemtic Name: 4-[3-nitro-5-(3-nitropyrazol-1-yl)-1,2,4-triazol-1-yl]butan-2-one Openeye Name: 4-[3-nitro-5-(3-nitropyrazol-1-yl)-1,2,4-triazol-1-yl]butan-2-one CAS Name: 4-[3-nitro-5-(3-nitro-1-pyrazolyl)-1,2,4-triazol-1-yl]-2-butanone IUPAC Name: 4-[3-nitro-5-(3-nitropyrazol-1-yl)-1,2,4-triazol-1-yl]butan-2-one Traditional Name: 4-[3-nitro-5-(3-nitropyrazol-1-yl)-1,2,4-triazol-1-yl]butan-2-one Formula: C9H9N7O5 MolecularWeight: 295.21166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCN1C(=NC(=N1)[N+](=O)[O-])N2C=CC(=N2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)CCN1C(=NC(=N1)[N+](=O)[O-])N2C=CC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C9H9N7O5/c1-6(17)2-4-14-9(10-8(12-14)16(20)21)13-5-3-7(11-13)15(18)19/h3,5H,2,4H2,1H3