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1-piperidin-1-ium-1-ylpropan-2-yl thiophene-2-carboxylate chloride

1-piperidin-1-ium-1-ylpropan-2-yl thiophene-2-carboxylate chloride

Systemtic Name:1-piperidin-1-ium-1-ylpropan-2-yl thiophene-2-carboxylate chloride
Openeye Name:(1-methyl-2-piperidin-1-ium-1-yl-ethyl) thiophene-2-carboxylate chloride
CAS Name:2-thiophenecarboxylic acid 1-(1-piperidin-1-iumyl)propan-2-yl ester chloride
IUPAC Name:1-piperidin-1-ium-1-ylpropan-2-yl thiophene-2-carboxylate chloride
Traditional Name:thiophene-2-carboxylic acid (1-methyl-2-piperidin-1-ium-1-yl-ethyl) ester chloride
Formula: C13H20ClNO2S
MolecularWeight: 289.8214
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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH+]1CCCCC1)OC(=O)C2=CC=CS2.[Cl-]


Isomeric SMILES

CC(C[NH+]1CCCCC1)OC(=O)C2=CC=CS2.[Cl-]


InChI

InChI=1S/C13H19NO2S.ClH/c1-11(10-14-7-3-2-4-8-14)16-13(15)12-6-5-9-17-12;/h5-6,9,11H,2-4,7-8,10H2,1H3;1H


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