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

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylphenoxy)ethanone Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-(4-phenylphenoxy)ethanone IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone Formula: C31H31N2O2+ MolecularWeight: 463.59004

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)COC4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H30N2O2/c34-30(24-35-29-18-16-26(17-19-29)25-10-4-1-5-11-25)32-20-22-33(23-21-32)31(27-12-6-2-7-13-27)28-14-8-3-9-15-28/h1-19,31H,20-24H2/p+1