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

Systemtic Name: 2-[4-[2-(4-acetamidophenyl)ethanoyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-[2-(4-acetamidophenyl)acetyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[2-(4-acetamidophenyl)-1-oxoethyl]-1-piperazin-1-iumyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-[2-(4-acetamidophenyl)acetyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-[2-(4-acetamidophenyl)acetyl]piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Formula: C22H26FN4O3+ MolecularWeight: 413.465243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CC(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H25FN4O3/c1-16(28)24-19-6-2-17(3-7-19)14-22(30)27-12-10-26(11-13-27)15-21(29)25-20-8-4-18(23)5-9-20/h2-9H,10-15H2,1H3,(H,24,28)(H,25,29)/p+1