2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[4-(5-bromanylfuran-2-yl)carbonylpiperazin-1-ium-1-yl]-N-(4-fluorophenyl)ethanamide Openeye Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide CAS Name: 2-[4-[(5-bromo-2-furanyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(4-fluorophenyl)acetamide IUPAC Name: 2-[4-(5-bromofuran-2-carbonyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Traditional Name: 2-[4-(5-bromo-2-furoyl)piperazin-1-ium-1-yl]-N-(4-fluorophenyl)acetamide Formula: C17H18BrFN3O3+ MolecularWeight: 411.245523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C17H17BrFN3O3/c18-15-6-5-14(25-15)17(24)22-9-7-21(8-10-22)11-16(23)20-13-3-1-12(19)2-4-13/h1-6H,7-11H2,(H,20,23)/p+1