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ethyl-di(hexadecanoyl)-(2-hydroxyethyl)azanium; methyl sulfate

ethyl-di(hexadecanoyl)-(2-hydroxyethyl)azanium; methyl sulfate

Systemtic Name:ethyl-di(hexadecanoyl)-(2-hydroxyethyl)azanium; methyl sulfate
Openeye Name:ethyl-di(hexadecanoyl)-(2-hydroxyethyl)ammonium; methyl sulfate
CAS Name:ethyl-(2-hydroxyethyl)-bis(1-oxohexadecyl)ammonium; methyl sulfate
IUPAC Name:ethyl-di(hexadecanoyl)-(2-hydroxyethyl)azanium; methyl sulfate
Traditional Name:ethyl-di(hexadecanoyl)-(2-hydroxyethyl)ammonium; methyl sulfate
Formula: C37H75NO7S
MolecularWeight: 678.0589
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)[N+](CC)(CCO)C(=O)CCCCCCCCCCCCCCC.COS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)[N+](CC)(CCO)C(=O)CCCCCCCCCCCCCCC.COS(=O)(=O)[O-]


InChI

InChI=1S/C36H72NO3.CH4O4S/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-35(39)37(6-3,33-34-38)36(40)32-30-28-26-24-22-20-18-16-14-12-10-8-5-2;1-5-6(2,3)4/h38H,4-34H2,1-3H3;1H3,(H,2,3,4)/q+1;/p-1


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