2-oxidanylbutanedioate; tris(2-hydroxyethyl)azanium

Systemtic Name: 2-oxidanylbutanedioate; tris(2-hydroxyethyl)azanium Openeye Name: 2-hydroxybutanedioate; tris(2-hydroxyethyl)ammonium CAS Name: 2-hydroxybutanedioate; tris(2-hydroxyethyl)ammonium IUPAC Name: 2-hydroxybutanedioate; tris(2-hydroxyethyl)azanium Traditional Name: 2-hydroxysuccinate; tris(2-hydroxyethyl)ammonium Formula: C16H36N2O11 MolecularWeight: 432.46384

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Descriptors Computed from Structure

Canonical SMILES:

C(CO)[NH+](CCO)CCO.C(CO)[NH+](CCO)CCO.C(C(C(=O)[O-])O)C(=O)[O-]

Isomeric SMILES

C(CO)[NH+](CCO)CCO.C(CO)[NH+](CCO)CCO.C(C(C(=O)[O-])O)C(=O)[O-]

InChI

InChI=1S/2C6H15NO3.C4H6O5/c2*8-4-1-7(2-5-9)3-6-10;5-2(4(8)9)1-3(6)7/h2*8-10H,1-6H2;2,5H,1H2,(H,6,7)(H,8,9)