N-(3-methyl-1H-benzimidazol-3-ium-2-yl)-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(3-methyl-1H-benzimidazol-3-ium-2-yl)-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(3-methyl-1H-benzimidazol-3-ium-2-yl)-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(3-methyl-1H-benzimidazol-3-ium-2-yl)-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(3-methyl-1H-benzimidazol-3-ium-2-yl)-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(3-methyl-1H-benzimidazol-3-ium-2-yl)-4-nitro-1H-pyrazole-5-carboxamide Formula: C12H11N6O3+ MolecularWeight: 287.25414

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(NC2=CC=CC=C21)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

Isomeric SMILES

C[N+]1=C(NC2=CC=CC=C21)NC(=O)C3=C(C=NN3)[N+](=O)[O-]

InChI

InChI=1S/C12H10N6O3/c1-17-8-5-3-2-4-7(8)14-12(17)15-11(19)10-9(18(20)21)6-13-16-10/h2-6H,1H3,(H2,13,14,15,16,19)/p+1