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5-[diethyl(octadecyl)azaniumyl]pentanoate

5-[diethyl(octadecyl)azaniumyl]pentanoate

Systemtic Name:5-[diethyl(octadecyl)azaniumyl]pentanoate
Openeye Name:5-[diethyl(octadecyl)ammonio]pentanoate
CAS Name:5-[diethyl(octadecyl)ammonio]pentanoate
IUPAC Name:5-[diethyl(octadecyl)azaniumyl]pentanoate
Traditional Name:5-[diethyl(stearyl)ammonio]valerate
Formula: C27H55NO2
MolecularWeight: 425.7311
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](CC)(CC)CCCCC(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](CC)(CC)CCCCC(=O)[O-]


InChI

InChI=1S/C27H55NO2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-25-28(5-2,6-3)26-23-21-24-27(29)30/h4-26H2,1-3H3


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