1-(2,3-dihydro-1,4-benzodioxin-5-yl)butane-1,3-dione

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)butane-1,3-dione Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)butane-1,3-dione CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)butane-1,3-dione IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)butane-1,3-dione Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-5-yl)butane-1,3-dione Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C1=C2C(=CC=C1)OCCO2

Isomeric SMILES

CC(=O)CC(=O)C1=C2C(=CC=C1)OCCO2

InChI

InChI=1S/C12H12O4/c1-8(13)7-10(14)9-3-2-4-11-12(9)16-6-5-15-11/h2-4H,5-7H2,1H3