N-(5-bromanylpyridin-2-yl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]acetamide Formula: C17H19BrFN4O+ MolecularWeight: 394.261363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=NC=C(C=C2)Br)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=NC=C(C=C2)Br)C3=CC=CC=C3F

InChI

InChI=1S/C17H18BrFN4O/c18-13-5-6-16(20-11-13)21-17(24)12-22-7-9-23(10-8-22)15-4-2-1-3-14(15)19/h1-6,11H,7-10,12H2,(H,20,21,24)/p+1