(2S)-1-(4-bromanylphenoxy)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propan-2-ol

Systemtic Name: (2S)-1-(4-bromanylphenoxy)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propan-2-ol Openeye Name: (2S)-1-(4-bromophenoxy)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propan-2-ol CAS Name: (2S)-1-(4-bromophenoxy)-3-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]-2-propanol IUPAC Name: (2S)-1-(4-bromophenoxy)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propan-2-ol Traditional Name: (2S)-1-(4-bromophenoxy)-3-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]propan-2-ol Formula: C16H26BrN2O2+ MolecularWeight: 358.29384

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)CC(COC2=CC=C(C=C2)Br)O

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C[C@@H](COC2=CC=C(C=C2)Br)O

InChI

InChI=1S/C16H25BrN2O2/c1-18-9-7-14(8-10-18)19(2)11-15(20)12-21-16-5-3-13(17)4-6-16/h3-6,14-15,20H,7-12H2,1-2H3/p+1/t15-/m0/s1