2-bromanyl-5-fluoranyl-N-(4-methylpiperazin-4-ium-1-yl)benzamide

Systemtic Name: 2-bromanyl-5-fluoranyl-N-(4-methylpiperazin-4-ium-1-yl)benzamide Openeye Name: 2-bromo-5-fluoro-N-(4-methylpiperazin-4-ium-1-yl)benzamide CAS Name: 2-bromo-5-fluoro-N-(4-methyl-1-piperazin-4-iumyl)benzamide IUPAC Name: 2-bromo-5-fluoro-N-(4-methylpiperazin-4-ium-1-yl)benzamide Traditional Name: 2-bromo-5-fluoro-N-(4-methylpiperazin-4-ium-1-yl)benzamide Formula: C12H16BrFN3O+ MolecularWeight: 317.177343

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)C2=C(C=CC(=C2)F)Br

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)C2=C(C=CC(=C2)F)Br

InChI

InChI=1S/C12H15BrFN3O/c1-16-4-6-17(7-5-16)15-12(18)10-8-9(14)2-3-11(10)13/h2-3,8H,4-7H2,1H3,(H,15,18)/p+1