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2-piperidin-1-ium-1-ylethyl 2-ethyl-2-methyl-hexanoate chloride

2-piperidin-1-ium-1-ylethyl 2-ethyl-2-methyl-hexanoate chloride

Systemtic Name:2-piperidin-1-ium-1-ylethyl 2-ethyl-2-methyl-hexanoate chloride
Openeye Name:2-piperidin-1-ium-1-ylethyl 2-ethyl-2-methyl-hexanoate chloride
CAS Name:2-ethyl-2-methylhexanoic acid 2-(1-piperidin-1-iumyl)ethyl ester chloride
IUPAC Name:2-piperidin-1-ium-1-ylethyl 2-ethyl-2-methylhexanoate chloride
Traditional Name:2-ethyl-2-methyl-hexanoic acid 2-piperidin-1-ium-1-ylethyl ester chloride
Formula: C16H32ClNO2
MolecularWeight: 305.88378
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC)C(=O)OCC[NH+]1CCCCC1.[Cl-]


Isomeric SMILES

CCCCC(C)(CC)C(=O)OCC[NH+]1CCCCC1.[Cl-]


InChI

InChI=1S/C16H31NO2.ClH/c1-4-6-10-16(3,5-2)15(18)19-14-13-17-11-8-7-9-12-17;/h4-14H2,1-3H3;1H


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