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

Systemtic Name: 1-dodecyl-2-[6-(1-dodecylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride Openeye Name: 1-dodecyl-2-[6-(1-dodecylbenzimidazol-2-yl)-2-pyridyl]benzimidazole; neodymium(3+); trichloride CAS Name: 1-dodecyl-2-[6-(1-dodecyl-2-benzimidazolyl)-2-pyridinyl]benzimidazole; neodymium(3+); trichloride IUPAC Name: 1-dodecyl-2-[6-(1-dodecylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride Traditional Name: 1-lauryl-2-[6-(1-laurylbenzimidazol-2-yl)-2-pyridyl]benzimidazole; neodymium(3+); trichloride Formula: C43H61Cl3N5Nd MolecularWeight: 898.57694

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=CC=CC=C2N=C1C3=NC(=CC=C3)C4=NC5=CC=CC=C5N4CCCCCCCCCCCC.[Cl-].[Cl-].[Cl-].[Nd+3]

Isomeric SMILES

CCCCCCCCCCCCN1C2=CC=CC=C2N=C1C3=NC(=CC=C3)C4=NC5=CC=CC=C5N4CCCCCCCCCCCC.[Cl-].[Cl-].[Cl-].[Nd+3]

InChI

InChI=1S/C43H61N5.3ClH.Nd/c1-3-5-7-9-11-13-15-17-19-25-34-47-40-32-23-21-28-36(40)45-42(47)38-30-27-31-39(44-38)43-46-37-29-22-24-33-41(37)48(43)35-26-20-18-16-14-12-10-8-6-4-2;;;;/h21-24,27-33H,3-20,25-26,34-35H2,1-2H3;3*1H;/q;;;;+3/p-3