1,4-bis(4-phenylmethoxybut-2-ynyl)piperazine-1,4-diium dichloride

Systemtic Name: 1,4-bis(4-phenylmethoxybut-2-ynyl)piperazine-1,4-diium dichloride Openeye Name: 1,4-bis(4-benzyloxybut-2-ynyl)piperazine-1,4-diium dichloride CAS Name: 1,4-bis(4-phenylmethoxybut-2-ynyl)piperazine-1,4-diium dichloride IUPAC Name: 1,4-bis(4-phenylmethoxybut-2-ynyl)piperazine-1,4-diium dichloride Traditional Name: 1,4-bis(4-benzoxybut-2-ynyl)piperazine-1,4-diium dichloride Formula: C26H32Cl2N2O2 MolecularWeight: 475.45048

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC#CCOCC2=CC=CC=C2)CC#CCOCC3=CC=CC=C3.[Cl-].[Cl-]

Isomeric SMILES

C1C[NH+](CC[NH+]1CC#CCOCC2=CC=CC=C2)CC#CCOCC3=CC=CC=C3.[Cl-].[Cl-]

InChI

InChI=1S/C26H30N2O2.2ClH/c1-3-11-25(12-4-1)23-29-21-9-7-15-27-17-19-28(20-18-27)16-8-10-22-30-24-26-13-5-2-6-14-26;;/h1-6,11-14H,15-24H2;2*1H