1-butyl-3-methyl-imidazol-3-ium; 3,5-dinitro-1,2-diaza-4-azanidacyclopenta-2,5-diene

Systemtic Name: 1-butyl-3-methyl-imidazol-3-ium; 3,5-dinitro-1,2-diaza-4-azanidacyclopenta-2,5-diene Openeye Name: 1-butyl-3-methyl-imidazol-3-ium; 3,5-dinitro-1,2-diaza-4-azanidacyclopenta-2,5-diene CAS Name: 1-butyl-3-methylimidazol-3-ium; 3,5-dinitro-1,2-diaza-4-azanidacyclopenta-2,5-diene IUPAC Name: 1-butyl-3-methylimidazol-3-ium; 3,5-dinitro-1,2-diaza-4-azanidacyclopenta-2,5-diene Traditional Name: 1-butyl-3-methyl-imidazol-3-ium; 3,5-dinitro-1,2-diaza-4-azanidacyclopenta-2,5-diene Formula: C10H15N7O4 MolecularWeight: 297.2706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C[N+](=C1)C.C1(=NN=C([N-]1)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCCCN1C=C[N+](=C1)C.C1(=NN=C([N-]1)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C8H15N2.C2N5O4/c1-3-4-5-10-7-6-9(2)8-10;8-6(9)1-3-2(5-4-1)7(10)11/h6-8H,3-5H2,1-2H3;/q+1;-1