2-benzofuran-1,3-dione; ethanone; propan-2-one; zirconium(2+)

Systemtic Name: 2-benzofuran-1,3-dione; ethanone; propan-2-one; zirconium(2+) Openeye Name: acetone; ethanone; isobenzofuran-1,3-dione; zirconium(2+) CAS Name: ethanone; isobenzofuran-1,3-dione; 2-propanone; zirconium(2+) IUPAC Name: 2-benzofuran-1,3-dione; ethanone; propan-2-one; zirconium(2+) Traditional Name: acetone; ethanone; phthalic anhydride; zirconium(2+) Formula: C13H13O5Zr+ MolecularWeight: 340.46332

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]=O.CC(=O)C.C1=CC=C2C(=C1)C(=O)OC2=O.[Zr+2]

Isomeric SMILES

C[C-]=O.CC(=O)C.C1=CC=C2C(=C1)C(=O)OC2=O.[Zr+2]

InChI

InChI=1S/C8H4O3.C3H6O.C2H3O.Zr/c9-7-5-3-1-2-4-6(5)8(10)11-7;1-3(2)4;1-2-3;/h1-4H;1-2H3;1H3;/q;;-1;+2