1-(phenylmethyl)-1-[10-[1-(phenylmethyl)piperazine-1,4-diium-1-yl]decyl]piperazine-1,4-diium dibromide dichloride

Systemtic Name: 1-(phenylmethyl)-1-[10-[1-(phenylmethyl)piperazine-1,4-diium-1-yl]decyl]piperazine-1,4-diium dibromide dichloride Openeye Name: 1-benzyl-1-[10-(1-benzylpiperazine-1,4-diium-1-yl)decyl]piperazine-1,4-diium dibromide dichloride CAS Name: 1-(phenylmethyl)-1-[10-[1-(phenylmethyl)-1-piperazine-1,4-diiumyl]decyl]piperazine-1,4-diium dibromide dichloride IUPAC Name: 1-benzyl-1-[10-(1-benzylpiperazine-1,4-diium-1-yl)decyl]piperazine-1,4-diium dibromide dichloride Traditional Name: 1-benzyl-1-[10-(1-benzylpiperazine-1,4-diium-1-yl)decyl]piperazine-1,4-diium dibromide dichloride Formula: C32H54Br2Cl2N4 MolecularWeight: 725.51196

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CC[NH2+]1)(CCCCCCCCCC[N+]2(CC[NH2+]CC2)CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-].[Cl-].[Br-].[Br-]

Isomeric SMILES

C1C[N+](CC[NH2+]1)(CCCCCCCCCC[N+]2(CC[NH2+]CC2)CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-].[Cl-].[Br-].[Br-]

InChI

InChI=1S/C32H52N4.2BrH.2ClH/c1(3-5-13-23-35(25-19-33-20-26-35)29-31-15-9-7-10-16-31)2-4-6-14-24-36(27-21-34-22-28-36)30-32-17-11-8-12-18-32;;;;/h7-12,15-18,33-34H,1-6,13-14,19-30H2;4*1H/q+2;;;;/p-2