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

Systemtic Name: 1-decyl-2-[6-(1-decylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride Openeye Name: 1-decyl-2-[6-(1-decylbenzimidazol-2-yl)-2-pyridyl]benzimidazole; neodymium(3+); trichloride CAS Name: 1-decyl-2-[6-(1-decyl-2-benzimidazolyl)-2-pyridinyl]benzimidazole; neodymium(3+); trichloride IUPAC Name: 1-decyl-2-[6-(1-decylbenzimidazol-2-yl)pyridin-2-yl]benzimidazole; neodymium(3+); trichloride Traditional Name: 1-decyl-2-[6-(1-decylbenzimidazol-2-yl)-2-pyridyl]benzimidazole; neodymium(3+); trichloride Formula: C39H53Cl3N5Nd MolecularWeight: 842.47062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN1C2=CC=CC=C2N=C1C3=NC(=CC=C3)C4=NC5=CC=CC=C5N4CCCCCCCCCC.[Cl-].[Cl-].[Cl-].[Nd+3]

Isomeric SMILES

CCCCCCCCCCN1C2=CC=CC=C2N=C1C3=NC(=CC=C3)C4=NC5=CC=CC=C5N4CCCCCCCCCC.[Cl-].[Cl-].[Cl-].[Nd+3]

InChI

InChI=1S/C39H53N5.3ClH.Nd/c1-3-5-7-9-11-13-15-21-30-43-36-28-19-17-24-32(36)41-38(43)34-26-23-27-35(40-34)39-42-33-25-18-20-29-37(33)44(39)31-22-16-14-12-10-8-6-4-2;;;;/h17-20,23-29H,3-16,21-22,30-31H2,1-2H3;3*1H;/q;;;;+3/p-3