2-benzofuran-1,3-dione; ethane-1,2-diol; furan-2,5-dione; propane-1,2-diol; terephthalic acid

Systemtic Name: 2-benzofuran-1,3-dione; ethane-1,2-diol; furan-2,5-dione; propane-1,2-diol; terephthalic acid Openeye Name: ethylene glycol; furan-2,5-dione; isobenzofuran-1,3-dione; propane-1,2-diol; terephthalic acid CAS Name: ethane-1,2-diol; furan-2,5-dione; isobenzofuran-1,3-dione; propane-1,2-diol; terephthalic acid IUPAC Name: 2-benzofuran-1,3-dione; ethane-1,2-diol; furan-2,5-dione; propane-1,2-diol; terephthalic acid Traditional Name: ethylene glycol; furan-2,5-quinone; phthalic anhydride; propane-1,2-diol; terephthalic acid Formula: C25H26O14 MolecularWeight: 550.46554

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(CO)O

Isomeric SMILES

CC(CO)O.C1=CC=C2C(=C1)C(=O)OC2=O.C1=CC(=CC=C1C(=O)O)C(=O)O.C1=CC(=O)OC1=O.C(CO)O

InChI

InChI=1S/C8H6O4.C8H4O3.C4H2O3.C3H8O2.C2H6O2/c9-7(10)5-1-2-6(4-3-5)8(11)12;9-7-5-3-1-2-4-6(5)8(10)11-7;5-3-1-2-4(6)7-3;1-3(5)2-4;3-1-2-4/h1-4H,(H,9,10)(H,11,12);1-4H;1-2H;3-5H,2H2,1H3;3-4H,1-2H2