1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[4-(3-chlorophenyl)-1-piperazinyl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-[4-(3-chlorophenyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[4-(3-chlorophenyl)piperazino]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C22H28ClN4O+ MolecularWeight: 399.93692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN4O/c23-19-5-4-8-21(17-19)26-13-15-27(16-14-26)22(28)18-24-9-11-25(12-10-24)20-6-2-1-3-7-20/h1-8,17H,9-16,18H2/p+1