3-methyl-4,5,6-tris(oxidanyl)-3H-2-benzofuran-1-one

Systemtic Name: 3-methyl-4,5,6-tris(oxidanyl)-3H-2-benzofuran-1-one Openeye Name: 4,5,6-trihydroxy-3-methyl-3H-isobenzofuran-1-one CAS Name: 4,5,6-trihydroxy-3-methyl-3H-isobenzofuran-1-one IUPAC Name: 4,5,6-trihydroxy-3-methyl-3H-2-benzofuran-1-one Traditional Name: 4,5,6-trihydroxy-3-methyl-phthalide Formula: C9H8O5 MolecularWeight: 196.15682

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C(=C(C=C2C(=O)O1)O)O)O

Isomeric SMILES

CC1C2=C(C(=C(C=C2C(=O)O1)O)O)O

InChI

InChI=1S/C9H8O5/c1-3-6-4(9(13)14-3)2-5(10)7(11)8(6)12/h2-3,10-12H,1H3