N-(4-fluorophenyl)-2-[4-[2-(2-phenylphenoxy)ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-[2-(2-phenylphenoxy)ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-[2-(2-phenylphenoxy)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[1-oxo-2-(2-phenylphenoxy)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-[2-(2-phenylphenoxy)acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-[2-(2-phenylphenoxy)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C26H27FN3O3+ MolecularWeight: 448.509283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)COC3=CC=CC=C3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)COC3=CC=CC=C3C4=CC=CC=C4

InChI

InChI=1S/C26H26FN3O3/c27-21-10-12-22(13-11-21)28-25(31)18-29-14-16-30(17-15-29)26(32)19-33-24-9-5-4-8-23(24)20-6-2-1-3-7-20/h1-13H,14-19H2,(H,28,31)/p+1