(4-bromanyl-3-oxidanylidene-pentan-2-yl) hydrogen carbonate

Systemtic Name: (4-bromanyl-3-oxidanylidene-pentan-2-yl) hydrogen carbonate Openeye Name: (3-bromo-1-methyl-2-oxo-butyl) hydrogen carbonate CAS Name: carbonic acid (4-bromo-3-oxopentan-2-yl) ester IUPAC Name: (4-bromo-3-oxopentan-2-yl) hydrogen carbonate Traditional Name: carbonic acid (3-bromo-2-keto-1-methyl-butyl) ester Formula: C6H9BrO4 MolecularWeight: 225.03726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C)Br)OC(=O)O

Isomeric SMILES

CC(C(=O)C(C)Br)OC(=O)O

InChI

InChI=1S/C6H9BrO4/c1-3(7)5(8)4(2)11-6(9)10/h3-4H,1-2H3,(H,9,10)