2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 3-(3-oxidanylpropoxy)propan-1-ol

Systemtic Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 3-(3-oxidanylpropoxy)propan-1-ol Openeye Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 3-(3-hydroxypropoxy)propan-1-ol; isobenzofuran-1,3-dione CAS Name: 2,2-bis(hydroxymethyl)propane-1,3-diol; 3-(3-hydroxypropoxy)-1-propanol; isobenzofuran-1,3-dione IUPAC Name: 2-benzofuran-1,3-dione; 2,2-bis(hydroxymethyl)propane-1,3-diol; 3-(3-hydroxypropoxy)propan-1-ol Traditional Name: 2,2-dimethylolpropane-1,3-diol; 3-(3-hydroxypropoxy)propan-1-ol; phthalic anhydride Formula: C19H30O10 MolecularWeight: 418.4355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H4O3.C6H14O3.C5H12O4/c9-7-5-3-1-2-4-6(5)8(10)11-7;7-3-1-5-9-6-2-4-8;6-1-5(2-7,3-8)4-9/h1-4H;7-8H,1-6H2;6-9H,1-4H2