4-(3-methyl-5-nitro-imidazol-4-yl)-1,2,4-triazole-3-carbonitrile

Systemtic Name: 4-(3-methyl-5-nitro-imidazol-4-yl)-1,2,4-triazole-3-carbonitrile Openeye Name: 4-(3-methyl-5-nitro-imidazol-4-yl)-1,2,4-triazole-3-carbonitrile CAS Name: 4-(3-methyl-5-nitro-4-imidazolyl)-1,2,4-triazole-3-carbonitrile IUPAC Name: 4-(3-methyl-5-nitroimidazol-4-yl)-1,2,4-triazole-3-carbonitrile Traditional Name: 4-(3-methyl-5-nitro-imidazol-4-yl)-1,2,4-triazole-3-carbonitrile Formula: C7H5N7O2 MolecularWeight: 219.1603

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N2C=NN=C2C#N)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N2C=NN=C2C#N)[N+](=O)[O-]

InChI

InChI=1S/C7H5N7O2/c1-12-3-9-6(14(15)16)7(12)13-4-10-11-5(13)2-8/h3-4H,1H3