1-[4-(phenylmethyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C23H31N4O+ MolecularWeight: 379.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H30N4O/c28-23(20-25-11-15-26(16-12-25)22-9-5-2-6-10-22)27-17-13-24(14-18-27)19-21-7-3-1-4-8-21/h1-10H,11-20H2/p+1