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ethyl-(2-hydroxyethyl)-octadecanoyl-(2-oxidanylidenenonadecyl)azanium

ethyl-(2-hydroxyethyl)-octadecanoyl-(2-oxidanylidenenonadecyl)azanium

Systemtic Name:ethyl-(2-hydroxyethyl)-octadecanoyl-(2-oxidanylidenenonadecyl)azanium
Openeye Name:ethyl-(2-hydroxyethyl)-octadecanoyl-(2-oxononadecyl)ammonium
CAS Name:ethyl-(2-hydroxyethyl)-(2-oxononadecyl)-(1-oxooctadecyl)ammonium
IUPAC Name:ethyl-(2-hydroxyethyl)-octadecanoyl-(2-oxononadecyl)azanium
Traditional Name:ethyl-(2-hydroxyethyl)-(2-ketononadecyl)-stearoyl-ammonium
Formula: C41H82NO3+
MolecularWeight: 637.09468
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C[N+](CC)(CCO)C(=O)CCCCCCCCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C[N+](CC)(CCO)C(=O)CCCCCCCCCCCCCCCCC


InChI

InChI=1S/C41H82NO3/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-40(44)39-42(6-3,37-38-43)41(45)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h43H,4-39H2,1-3H3/q+1


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