2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone

Systemtic Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-[(4-chlorophenyl)methyl]-1-piperazine-1,4-diiumyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-[4-[(4-chlorophenyl)methyl]piperazine-1,4-diium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-[4-(4-chlorobenzyl)piperazine-1,4-diium-1-yl]-1-(4-phenylpiperazino)ethanone Formula: C23H31ClN4O+2 MolecularWeight: 414.97144

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Cl)CC(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC=C(C=C2)Cl)CC(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

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