1-hexyl-2-[6-(1-hexylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride

Systemtic Name: 1-hexyl-2-[6-(1-hexylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride Openeye Name: 1-hexyl-2-[6-(1-hexylbenzimidazol-2-yl)-2-pyridyl]benzimidazole; neodymium(3+); trichloride CAS Name: 1-hexyl-2-[6-(1-hexyl-2-benzimidazolyl)-2-pyridinyl]benzimidazole; neodymium(3+); trichloride IUPAC Name: 1-hexyl-2-[6-(1-hexylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride Traditional Name: 1-hexyl-2-[6-(1-hexylbenzimidazol-2-yl)-2-pyridyl]benzimidazole; neodymium(3+); trichloride Formula: C31H37Cl3N5Nd MolecularWeight: 730.25798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1C3=NC(=CC=C3)C4=NC5=CC=CC=C5N4CCCCCC.[Cl-].[Cl-].[Cl-].[Nd+3]

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1C3=NC(=CC=C3)C4=NC5=CC=CC=C5N4CCCCCC.[Cl-].[Cl-].[Cl-].[Nd+3]

InChI

InChI=1S/C31H37N5.3ClH.Nd/c1-3-5-7-13-22-35-28-20-11-9-16-24(28)33-30(35)26-18-15-19-27(32-26)31-34-25-17-10-12-21-29(25)36(31)23-14-8-6-4-2;;;;/h9-12,15-21H,3-8,13-14,22-23H2,1-2H3;3*1H;/q;;;;+3/p-3