2-hydroxyethyl(trimethyl)azanium; phthalate

Systemtic Name: 2-hydroxyethyl(trimethyl)azanium; phthalate Openeye Name: 2-hydroxyethyl(trimethyl)ammonium; phthalate CAS Name: 2-hydroxyethyl(trimethyl)ammonium; phthalate IUPAC Name: 2-hydroxyethyl(trimethyl)azanium; phthalate Traditional Name: 2-hydroxyethyl(trimethyl)ammonium; phthalate Formula: C18H32N2O6 MolecularWeight: 372.45648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6O4.2C5H14NO/c9-7(10)5-3-1-2-4-6(5)8(11)12;2*1-6(2,3)4-5-7/h1-4H,(H,9,10)(H,11,12);2*7H,4-5H2,1-3H3/q;2*+1/p-2