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

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C23H31ClN4O+2 MolecularWeight: 414.97144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H29ClN4O/c24-21-8-6-20(7-9-21)18-25-12-16-28(17-13-25)23(29)19-26-10-14-27(15-11-26)22-4-2-1-3-5-22/h1-9H,10-19H2/p+2