N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-(1H-benzimidazol-2-yl)-5-methyl-1H-pyrazol-2-ium-3-yl]-4-methoxy-3-nitro-benzamide Formula: C19H17N6O4+ MolecularWeight: 393.37608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N6O4/c1-11-9-17(24(23-11)19-20-13-5-3-4-6-14(13)21-19)22-18(26)12-7-8-16(29-2)15(10-12)25(27)28/h3-10H,1-2H3,(H2,20,21,22,23,26)/p+1