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(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl) octadecanoate

(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl) octadecanoate

Systemtic Name:(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl) octadecanoate
Openeye Name:(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl) octadecanoate
CAS Name:octadecanoic acid (1,2,2,6,6-pentamethyl-1-piperidin-1-iumyl) ester
IUPAC Name:(1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl) octadecanoate
Traditional Name:stearic acid (1,2,2,6,6-pentamethylpiperidin-1-ium-1-yl) ester
Formula: C28H56NO2+
MolecularWeight: 438.74974
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O[N+]1(C(CCCC1(C)C)(C)C)C


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O[N+]1(C(CCCC1(C)C)(C)C)C


InChI

InChI=1S/C28H56NO2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-26(30)31-29(6)27(2,3)24-22-25-28(29,4)5/h7-25H2,1-6H3/q+1


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