(2R)-1-(2-bromanylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-(2-bromanylphenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-(2-bromophenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol CAS Name: (2R)-1-(2-bromophenoxy)-3-[(3R)-3-methyl-1-piperidin-1-iumyl]-2-propanol IUPAC Name: (2R)-1-(2-bromophenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-(2-bromophenoxy)-3-[(3R)-3-methylpiperidin-1-ium-1-yl]propan-2-ol Formula: C15H23BrNO2+ MolecularWeight: 329.25262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(COC2=CC=CC=C2Br)O

Isomeric SMILES

C[C@@H]1CCC[NH+](C1)C[C@H](COC2=CC=CC=C2Br)O

InChI

InChI=1S/C15H22BrNO2/c1-12-5-4-8-17(9-12)10-13(18)11-19-15-7-3-2-6-14(15)16/h2-3,6-7,12-13,18H,4-5,8-11H2,1H3/p+1/t12-,13-/m1/s1