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

Systemtic Name: 1-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[4-[(2-fluorophenyl)methyl]-1-piperazin-4-iumyl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-[4-[(2-fluorophenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[4-(2-fluorobenzyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C23H31FN4O+2 MolecularWeight: 398.516843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2F)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H29FN4O/c24-22-9-5-4-6-20(22)18-25-12-16-28(17-13-25)23(29)19-26-10-14-27(15-11-26)21-7-2-1-3-8-21/h1-9H,10-19H2/p+2