3H-2-benzofuran-1-one; 2-hydroxyethyl(trimethyl)azanium; chloride

Systemtic Name: 3H-2-benzofuran-1-one; 2-hydroxyethyl(trimethyl)azanium; chloride Openeye Name: 2-hydroxyethyl(trimethyl)ammonium; 3H-isobenzofuran-1-one; chloride CAS Name: 2-hydroxyethyl(trimethyl)ammonium; 3H-isobenzofuran-1-one; chloride IUPAC Name: 3H-2-benzofuran-1-one; 2-hydroxyethyl(trimethyl)azanium; chloride Traditional Name: 2-hydroxyethyl(trimethyl)ammonium; phthalide; chloride Formula: C13H20ClNO3 MolecularWeight: 273.7558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.C1C2=CC=CC=C2C(=O)O1.[Cl-]

Isomeric SMILES

C[N+](C)(C)CCO.C1C2=CC=CC=C2C(=O)O1.[Cl-]

InChI

InChI=1S/C8H6O2.C5H14NO.ClH/c9-8-7-4-2-1-3-6(7)5-10-8;1-6(2,3)4-5-7;/h1-4H,5H2;7H,4-5H2,1-3H3;1H/q;+1;/p-1