2-(4-chloranyl-3-nitro-phenyl)-1,3-dipyridin-2-yl-benzimidazol-3-ium iodide

Systemtic Name: 2-(4-chloranyl-3-nitro-phenyl)-1,3-dipyridin-2-yl-benzimidazol-3-ium iodide Openeye Name: 2-(4-chloro-3-nitro-phenyl)-1,3-bis(2-pyridyl)benzimidazol-3-ium iodide CAS Name: 2-(4-chloro-3-nitrophenyl)-1,3-bis(2-pyridinyl)benzimidazol-3-ium iodide IUPAC Name: 2-(4-chloro-3-nitrophenyl)-1,3-dipyridin-2-ylbenzimidazol-3-ium iodide Traditional Name: 2-(4-chloro-3-nitro-phenyl)-1,3-bis(2-pyridyl)benzimidazol-3-ium iodide Formula: C23H15ClIN5O2 MolecularWeight: 555.75497

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=[N+]2C3=CC=CC=N3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=N5.[I-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=[N+]2C3=CC=CC=N3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])C5=CC=CC=N5.[I-]

InChI

InChI=1S/C23H15ClN5O2.HI/c24-17-12-11-16(15-20(17)29(30)31)23-27(21-9-3-5-13-25-21)18-7-1-2-8-19(18)28(23)22-10-4-6-14-26-22;/h1-15H;1H/q+1;/p-1