1,4-bis[phenyl-(4-phenylphenyl)methyl]piperazine-1,4-diium dichloride

Systemtic Name: 1,4-bis[phenyl-(4-phenylphenyl)methyl]piperazine-1,4-diium dichloride Openeye Name: 1,4-bis[phenyl-(4-phenylphenyl)methyl]piperazine-1,4-diium dichloride CAS Name: 1,4-bis[phenyl-(4-phenylphenyl)methyl]piperazine-1,4-diium dichloride IUPAC Name: 1,4-bis[phenyl-(4-phenylphenyl)methyl]piperazine-1,4-diium dichloride Traditional Name: 1,4-bis[phenyl-(4-phenylphenyl)methyl]piperazine-1,4-diium dichloride Formula: C42H40Cl2N2 MolecularWeight: 643.6864

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1C(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=C(C=C6)C7=CC=CC=C7.[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+](CC[NH+]1C(C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=C(C=C6)C7=CC=CC=C7.[Cl-].[Cl-]

InChI

InChI=1S/C42H38N2.2ClH/c1-5-13-33(14-6-1)35-21-25-39(26-22-35)41(37-17-9-3-10-18-37)43-29-31-44(32-30-43)42(38-19-11-4-12-20-38)40-27-23-36(24-28-40)34-15-7-2-8-16-34;;/h1-28,41-42H,29-32H2;2*1H