N-(4-bromanyl-2-fluoranyl-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C18H20BrFN3O+ MolecularWeight: 393.273303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19BrFN3O/c19-14-6-7-17(16(20)12-14)21-18(24)13-22-8-10-23(11-9-22)15-4-2-1-3-5-15/h1-7,12H,8-11,13H2,(H,21,24)/p+1