copper 1-(triphenylmethyl)-4-[1-(triphenylmethyl)imidazol-4-yl]imidazole dinitrate

Systemtic Name: copper 1-(triphenylmethyl)-4-[1-(triphenylmethyl)imidazol-4-yl]imidazole dinitrate Openeye Name: copper 1-trityl-4-(1-tritylimidazol-4-yl)imidazole dinitrate CAS Name: copper 1-(triphenylmethyl)-4-[1-(triphenylmethyl)-4-imidazolyl]imidazole dinitrate IUPAC Name: copper 1-trityl-4-(1-tritylimidazol-4-yl)imidazole dinitrate Traditional Name: cupric 1-trityl-4-(1-tritylimidazol-4-yl)imidazole dinitrate Formula: C88H68CuN10O6 MolecularWeight: 1425.09092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)C5=CN(C=N5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)C5=CN(C=N5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)C5=CN(C=N5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)C5=CN(C=N5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8.[N+](=O)([O-])[O-].[N+](=O)([O-])[O-].[Cu+2]

InChI

InChI=1S/2C44H34N4.Cu.2NO3/c2*1-7-19-35(20-8-1)43(36-21-9-2-10-22-36,37-23-11-3-12-24-37)47-31-41(45-33-47)42-32-48(34-46-42)44(38-25-13-4-14-26-38,39-27-15-5-16-28-39)40-29-17-6-18-30-40;;2*2-1(3)4/h2*1-34H;;;/q;;+2;2*-1