2-(2-bromanyl-4-fluoranyl-phenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-fluoranyl-phenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]ethanamide Openeye Name: 2-(2-bromo-4-fluoro-phenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]acetamide CAS Name: 2-(2-bromo-4-fluorophenoxy)-N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]acetamide IUPAC Name: 2-(2-bromo-4-fluorophenoxy)-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]acetamide Traditional Name: 2-(2-bromo-4-fluoro-phenoxy)-N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]acetamide Formula: C20H22BrClFN2O2+ MolecularWeight: 456.756283

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)COC2=C(C=C(C=C2)F)Br)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[NH+](CCC1NC(=O)COC2=C(C=C(C=C2)F)Br)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21BrClFN2O2/c21-18-11-16(23)5-6-19(18)27-13-20(26)24-17-7-9-25(10-8-17)12-14-1-3-15(22)4-2-14/h1-6,11,17H,7-10,12-13H2,(H,24,26)/p+1