2-(2-bromanyl-4-chloranyl-phenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ethanamide

Systemtic Name: 2-(2-bromanyl-4-chloranyl-phenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ethanamide Openeye Name: 2-(2-bromo-4-chloro-phenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide CAS Name: 2-(2-bromo-4-chlorophenoxy)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]acetamide IUPAC Name: 2-(2-bromo-4-chlorophenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide Traditional Name: 2-(2-bromo-4-chloro-phenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide Formula: C17H25BrClN2O2+ MolecularWeight: 404.7496

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)COC2=C(C=C(C=C2)Cl)Br

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)COC2=C(C=C(C=C2)Cl)Br

InChI

InChI=1S/C17H24BrClN2O2/c1-13-5-2-3-9-21(13)10-4-8-20-17(22)12-23-16-7-6-14(19)11-15(16)18/h6-7,11,13H,2-5,8-10,12H2,1H3,(H,20,22)/p+1/t13-/m0/s1