hexanedioate; tris(2-hydroxyethyl)azanium

Systemtic Name: hexanedioate; tris(2-hydroxyethyl)azanium Openeye Name: hexanedioate; tris(2-hydroxyethyl)ammonium CAS Name: hexanedioate; tris(2-hydroxyethyl)ammonium IUPAC Name: hexanedioate; tris(2-hydroxyethyl)azanium Traditional Name: adipate; tris(2-hydroxyethyl)ammonium Formula: C18H40N2O10 MolecularWeight: 444.5176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C6H15NO3.C6H10O4/c2*8-4-1-7(2-5-9)3-6-10;7-5(8)3-1-2-4-6(9)10/h2*8-10H,1-6H2;1-4H2,(H,7,8)(H,9,10)