2-benzofuran-1,3-dione; furan-2,5-dione; 2-methylpropane-1,3-diol

Systemtic Name: 2-benzofuran-1,3-dione; furan-2,5-dione; 2-methylpropane-1,3-diol Openeye Name: furan-2,5-dione; isobenzofuran-1,3-dione; 2-methylpropane-1,3-diol CAS Name: furan-2,5-dione; isobenzofuran-1,3-dione; 2-methylpropane-1,3-diol IUPAC Name: 2-benzofuran-1,3-dione; furan-2,5-dione; 2-methylpropane-1,3-diol Traditional Name: furan-2,5-quinone; 2-methylpropane-1,3-diol; phthalic anhydride Formula: C16H16O8 MolecularWeight: 336.29344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H4O3.C4H2O3.C4H10O2/c9-7-5-3-1-2-4-6(5)8(10)11-7;5-3-1-2-4(6)7-3;1-4(2-5)3-6/h1-4H;1-2H;4-6H,2-3H2,1H3