N-(5-bromanylpyridin-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C17H20BrN4O+ MolecularWeight: 376.2709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19BrN4O/c18-14-6-7-16(19-12-14)20-17(23)13-21-8-10-22(11-9-21)15-4-2-1-3-5-15/h1-7,12H,8-11,13H2,(H,19,20,23)/p+1