1,4-bis[4-(2-phenylmethoxyethoxy)but-2-ynyl]piperazine-1,4-diium dichloride

Systemtic Name: 1,4-bis[4-(2-phenylmethoxyethoxy)but-2-ynyl]piperazine-1,4-diium dichloride Openeye Name: 1,4-bis[4-(2-benzyloxyethoxy)but-2-ynyl]piperazine-1,4-diium dichloride CAS Name: 1,4-bis[4-(2-phenylmethoxyethoxy)but-2-ynyl]piperazine-1,4-diium dichloride IUPAC Name: 1,4-bis[4-(2-phenylmethoxyethoxy)but-2-ynyl]piperazine-1,4-diium dichloride Traditional Name: 1,4-bis[4-(2-benzoxyethoxy)but-2-ynyl]piperazine-1,4-diium dichloride Formula: C30H40Cl2N2O4 MolecularWeight: 563.5556

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC#CCOCCOCC2=CC=CC=C2)CC#CCOCCOCC3=CC=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+](CC[NH+]1CC#CCOCCOCC2=CC=CC=C2)CC#CCOCCOCC3=CC=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C30H38N2O4.2ClH/c1-3-11-29(12-4-1)27-35-25-23-33-21-9-7-15-31-17-19-32(20-18-31)16-8-10-22-34-24-26-36-28-30-13-5-2-6-14-30;;/h1-6,11-14H,15-28H2;2*1H