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methyl sulfate; triethyl-[(octadecanoylamino)methyl]azanium

methyl sulfate; triethyl-[(octadecanoylamino)methyl]azanium

Systemtic Name:methyl sulfate; triethyl-[(octadecanoylamino)methyl]azanium
Openeye Name:methyl sulfate; triethyl-[(octadecanoylamino)methyl]ammonium
CAS Name:methyl sulfate; triethyl-[(1-oxooctadecylamino)methyl]ammonium
IUPAC Name:methyl sulfate; triethyl-[(octadecanoylamino)methyl]azanium
Traditional Name:methyl sulfate; triethyl(stearamidomethyl)ammonium
Formula: C26H56N2O5S
MolecularWeight: 508.79824
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC[N+](CC)(CC)CC.COS(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC[N+](CC)(CC)CC.COS(=O)(=O)[O-]


InChI

InChI=1S/C25H52N2O.CH4O4S/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25(28)26-24-27(6-2,7-3)8-4;1-5-6(2,3)4/h5-24H2,1-4H3;1H3,(H,2,3,4)


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