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didecyl(dimethyl)azanium; 2-oxidanylpropane-1,2,3-tricarboxylate

didecyl(dimethyl)azanium; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name:didecyl(dimethyl)azanium; 2-oxidanylpropane-1,2,3-tricarboxylate
Openeye Name:didecyl(dimethyl)ammonium citrate
CAS Name:didecyl(dimethyl)ammonium; 2-hydroxypropane-1,2,3-tricarboxylate
IUPAC Name:didecyl(dimethyl)azanium; 2-hydroxypropane-1,2,3-tricarboxylate
Traditional Name:didecyl(dimethyl)ammonium citrate
Formula: C28H53NO7-2
MolecularWeight: 515.72292
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O


Isomeric SMILES

CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O


InChI

InChI=1S/C22H48N.C6H8O7/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-22H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/q+1;/p-3


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