bis(2-hydroxyethyl)azanium; phthalate

Systemtic Name: bis(2-hydroxyethyl)azanium; phthalate Openeye Name: bis(2-hydroxyethyl)ammonium; phthalate CAS Name: bis(2-hydroxyethyl)ammonium; phthalate IUPAC Name: bis(2-hydroxyethyl)azanium; phthalate Traditional Name: bis(2-hydroxyethyl)ammonium; phthalate Formula: C16H28N2O8 MolecularWeight: 376.40212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C(CO)[NH2+]CCO.C(CO)[NH2+]CCO

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)[O-])C(=O)[O-].C(CO)[NH2+]CCO.C(CO)[NH2+]CCO

InChI

InChI=1S/C8H6O4.2C4H11NO2/c9-7(10)5-3-1-2-4-6(5)8(11)12;2*6-3-1-5-2-4-7/h1-4H,(H,9,10)(H,11,12);2*5-7H,1-4H2