1-(2,5-dimethoxyphenyl)butane-1,3-dione

Systemtic Name: 1-(2,5-dimethoxyphenyl)butane-1,3-dione Openeye Name: 1-(2,5-dimethoxyphenyl)butane-1,3-dione CAS Name: 1-(2,5-dimethoxyphenyl)butane-1,3-dione IUPAC Name: 1-(2,5-dimethoxyphenyl)butane-1,3-dione Traditional Name: 1-(2,5-dimethoxyphenyl)butane-1,3-dione Formula: C12H14O4 MolecularWeight: 222.23716

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=C(C=CC(=C1)OC)OC

Isomeric SMILES

CC(=O)CC(=O)C1=C(C=CC(=C1)OC)OC

InChI

InChI=1S/C12H14O4/c1-8(13)6-11(14)10-7-9(15-2)4-5-12(10)16-3/h4-5,7H,6H2,1-3H3