N-(4-bromanyl-2-chloranyl-phenyl)-2-[4-(2-fluorophenyl)carbonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-2-[4-(2-fluorophenyl)carbonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-2-[4-(2-fluorobenzoyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-bromo-2-chlorophenyl)-2-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-2-[4-(2-fluorobenzoyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-2-[4-(2-fluorobenzoyl)piperazin-1-ium-1-yl]acetamide Formula: C19H19BrClFN3O2+ MolecularWeight: 455.728463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18BrClFN3O2/c20-13-5-6-17(15(21)11-13)23-18(26)12-24-7-9-25(10-8-24)19(27)14-3-1-2-4-16(14)22/h1-6,11H,7-10,12H2,(H,23,26)/p+1