2-(3-bromanylphenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ethanamide

Systemtic Name: 2-(3-bromanylphenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ethanamide Openeye Name: 2-(3-bromophenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide CAS Name: 2-(3-bromophenoxy)-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]acetamide IUPAC Name: 2-(3-bromophenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide Traditional Name: 2-(3-bromophenoxy)-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]acetamide Formula: C17H26BrN2O2+ MolecularWeight: 370.30454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25BrN2O2/c1-14-6-2-3-10-20(14)11-5-9-19-17(21)13-22-16-8-4-7-15(18)12-16/h4,7-8,12,14H,2-3,5-6,9-11,13H2,1H3,(H,19,21)/p+1/t14-/m0/s1