2-hydroxyethyl(trimethyl)azanium; 1-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 2-hydroxyethyl(trimethyl)azanium; 1-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 2-hydroxyethyl(trimethyl)ammonium; 1-hydroxypropane-1,2,3-tricarboxylate CAS Name: 2-hydroxyethyl(trimethyl)ammonium; 1-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 2-hydroxyethyl(trimethyl)azanium; 1-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 2-hydroxyethyl(trimethyl)ammonium; 1-hydroxypropane-1,2,3-tricarboxylate Formula: C21H47N3O10 MolecularWeight: 501.61198

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C(C(C(C(=O)[O-])O)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C[N+](C)(C)CCO.C[N+](C)(C)CCO.C[N+](C)(C)CCO.C(C(C(C(=O)[O-])O)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C6H8O7.3C5H14NO/c7-3(8)1-2(5(10)11)4(9)6(12)13;3*1-6(2,3)4-5-7/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13);3*7H,4-5H2,1-3H3/q;3*+1/p-3