1,3-bis[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]propan-2-ol

Systemtic Name: 1,3-bis[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]propan-2-ol Openeye Name: 1,3-bis(4-benzhydrylpiperazine-1,4-diium-1-yl)propan-2-ol CAS Name: 1,3-bis[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-2-propanol IUPAC Name: 1,3-bis(4-benzhydrylpiperazine-1,4-diium-1-yl)propan-2-ol Traditional Name: 1,3-bis(4-benzhydrylpiperazine-1,4-diium-1-yl)propan-2-ol Formula: C37H48N4O+4 MolecularWeight: 564.80322

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC(C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C[NH+](CC[NH+]1CC(C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C37H44N4O/c42-35(29-38-21-25-40(26-22-38)36(31-13-5-1-6-14-31)32-15-7-2-8-16-32)30-39-23-27-41(28-24-39)37(33-17-9-3-10-18-33)34-19-11-4-12-20-34/h1-20,35-37,42H,21-30H2/p+4