2-benzofuran-1,3-dione; benzoic acid; 2-[2-(2-hydroxyethyloxy)ethoxy]ethanol

Systemtic Name: 2-benzofuran-1,3-dione; benzoic acid; 2-[2-(2-hydroxyethyloxy)ethoxy]ethanol Openeye Name: benzoic acid; 2-[2-(2-hydroxyethoxy)ethoxy]ethanol; isobenzofuran-1,3-dione CAS Name: benzoic acid; 2-[2-(2-hydroxyethoxy)ethoxy]ethanol; isobenzofuran-1,3-dione IUPAC Name: 2-benzofuran-1,3-dione; benzoic acid; 2-[2-(2-hydroxyethoxy)ethoxy]ethanol Traditional Name: benzoic acid; 2-[2-(2-hydroxyethoxy)ethoxy]ethanol; phthalic anhydride Formula: C21H24O9 MolecularWeight: 420.40986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O.C(COCCOCCO)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)O.C1=CC=C2C(=C1)C(=O)OC2=O.C(COCCOCCO)O

InChI

InChI=1S/C8H4O3.C7H6O2.C6H14O4/c9-7-5-3-1-2-4-6(5)8(10)11-7;8-7(9)6-4-2-1-3-5-6;7-1-3-9-5-6-10-4-2-8/h1-4H;1-5H,(H,8,9);7-8H,1-6H2