dihexadecyl-bis(hydroxymethyl)azanium ethanoate

Systemtic Name: dihexadecyl-bis(hydroxymethyl)azanium ethanoate Openeye Name: dihexadecyl-bis(hydroxymethyl)ammonium acetate CAS Name: dihexadecyl-bis(hydroxymethyl)ammonium acetate IUPAC Name: dihexadecyl-bis(hydroxymethyl)azanium acetate Traditional Name: dicetyl(dimethylol)ammonium acetate Formula: C36H75NO4 MolecularWeight: 585.985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCC)(CO)CO.CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCC)(CO)CO.CC(=O)[O-]

InChI

InChI=1S/C34H72NO2.C2H4O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(33-36,34-37)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-2(3)4/h36-37H,3-34H2,1-2H3;1H3,(H,3,4)/q+1;/p-1