1H-imidazol-1-ium; 3-imidazol-1-yl-7-nitro-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide

Systemtic Name: 1H-imidazol-1-ium; 3-imidazol-1-yl-7-nitro-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide Openeye Name: 1H-imidazol-1-ium; 3-imidazol-1-yl-7-nitro-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide CAS Name: 1H-imidazol-1-ium; 3-(1-imidazolyl)-7-nitro-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide IUPAC Name: 1H-imidazol-1-ium; 3-imidazol-1-yl-7-nitro-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide Traditional Name: 1H-imidazol-1-ium; 3-imidazol-1-yl-7-nitro-4H-1$l^{6},2,4-benzothiadiazine 1,1-dioxide Formula: C13H12N7O4S+ MolecularWeight: 362.34388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)N=C(N2)N3C=CN=C3.C1=CN=C[NH2+]1

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])S(=O)(=O)N=C(N2)N3C=CN=C3.C1=CN=C[NH2+]1

InChI

InChI=1S/C10H7N5O4S.C3H4N2/c16-15(17)7-1-2-8-9(5-7)20(18,19)13-10(12-8)14-4-3-11-6-14;1-2-5-3-4-1/h1-6H,(H,12,13);1-3H,(H,4,5)/p+1