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

Systemtic Name: 1-[4-(phenylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylphenoxy)ethanone Openeye Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperazin-4-iumyl]-2-(4-phenylphenoxy)ethanone IUPAC Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone Traditional Name: 1-(4-benzylpiperazin-4-ium-1-yl)-2-(4-phenylphenoxy)ethanone Formula: C25H27N2O2+ MolecularWeight: 387.49408

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O2/c28-25(27-17-15-26(16-18-27)19-21-7-3-1-4-8-21)20-29-24-13-11-23(12-14-24)22-9-5-2-6-10-22/h1-14H,15-20H2/p+1