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3-[3-(1-methylpiperidin-1-ium-1-yl)propoxy]butan-2-ol ethanoate

3-[3-(1-methylpiperidin-1-ium-1-yl)propoxy]butan-2-ol ethanoate

Systemtic Name:3-[3-(1-methylpiperidin-1-ium-1-yl)propoxy]butan-2-ol ethanoate
Openeye Name:3-[3-(1-methylpiperidin-1-ium-1-yl)propoxy]butan-2-ol acetate
CAS Name:3-[3-(1-methyl-1-piperidin-1-iumyl)propoxy]-2-butanol acetate
IUPAC Name:3-[3-(1-methylpiperidin-1-ium-1-yl)propoxy]butan-2-ol acetate
Traditional Name:3-[3-(1-methylpiperidin-1-ium-1-yl)propoxy]butan-2-ol acetate
Formula: C15H31NO4
MolecularWeight: 289.41094
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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)OCCC[N+]1(CCCCC1)C)O.CC(=O)[O-]


Isomeric SMILES

CC(C(C)OCCC[N+]1(CCCCC1)C)O.CC(=O)[O-]


InChI

InChI=1S/C13H28NO2.C2H4O2/c1-12(15)13(2)16-11-7-10-14(3)8-5-4-6-9-14;1-2(3)4/h12-13,15H,4-11H2,1-3H3;1H3,(H,3,4)/q+1;/p-1


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