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

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone Openeye Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-phenylpiperazin-1-yl)ethanone CAS Name: 2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-1-(4-phenyl-1-piperazinyl)ethanone IUPAC Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-phenylpiperazin-1-yl)ethanone Traditional Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-1-(4-phenylpiperazino)ethanone Formula: C29H35N4O+ MolecularWeight: 455.6144

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CCN(CC2)C3=CC=CC=C3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H34N4O/c34-28(32-22-20-31(21-23-32)27-14-8-3-9-15-27)24-30-16-18-33(19-17-30)29(25-10-4-1-5-11-25)26-12-6-2-7-13-26/h1-15,29H,16-24H2/p+1