1-(7-bromanyl-1,3-benzodioxol-5-yl)pentane-1,4-dione

Systemtic Name: 1-(7-bromanyl-1,3-benzodioxol-5-yl)pentane-1,4-dione Openeye Name: 1-(7-bromo-1,3-benzodioxol-5-yl)pentane-1,4-dione CAS Name: 1-(7-bromo-1,3-benzodioxol-5-yl)pentane-1,4-dione IUPAC Name: 1-(7-bromo-1,3-benzodioxol-5-yl)pentane-1,4-dione Traditional Name: 1-(7-bromo-1,3-benzodioxol-5-yl)pentane-1,4-dione Formula: C12H11BrO4 MolecularWeight: 299.11734

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(=O)C1=CC2=C(C(=C1)Br)OCO2

Isomeric SMILES

CC(=O)CCC(=O)C1=CC2=C(C(=C1)Br)OCO2

InChI

InChI=1S/C12H11BrO4/c1-7(14)2-3-10(15)8-4-9(13)12-11(5-8)16-6-17-12/h4-5H,2-3,6H2,1H3