N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-5-nitro-furan-2-carboxamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-5-nitro-furan-2-carboxamide CAS Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-5-nitro-2-furancarboxamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-5-nitrofuran-2-carboxamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-5-nitro-2-furamide Formula: C16H13N6O4+ MolecularWeight: 353.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=[N+](N1)C2=NC3=CC=CC=C3N2)NC(=O)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C16H12N6O4/c1-9-8-13(19-15(23)12-6-7-14(26-12)22(24)25)21(20-9)16-17-10-4-2-3-5-11(10)18-16/h2-8H,1H3,(H2,17,18,19,20,23)/p+1