3-methoxy-N-(1-methylbenzimidazol-2-yl)-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 3-methoxy-N-(1-methylbenzimidazol-2-yl)-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: 3-methoxy-N-(1-methylbenzimidazol-2-yl)-4-nitro-1H-pyrazole-5-carboxamide CAS Name: 3-methoxy-N-(1-methyl-2-benzimidazolyl)-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 3-methoxy-N-(1-methylbenzimidazol-2-yl)-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: 3-methoxy-N-(1-methylbenzimidazol-2-yl)-4-nitro-1H-pyrazole-5-carboxamide Formula: C13H12N6O4 MolecularWeight: 316.27218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2N=C1NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H12N6O4/c1-18-8-6-4-3-5-7(8)14-13(18)15-11(20)9-10(19(21)22)12(23-2)17-16-9/h3-6H,1-2H3,(H,16,17)(H,14,15,20)