methyl (E)-3-acetyloxy-4-bromanyl-but-2-enoate

Systemtic Name: methyl (E)-3-acetyloxy-4-bromanyl-but-2-enoate Openeye Name: methyl (E)-3-acetoxy-4-bromo-but-2-enoate CAS Name: (E)-3-acetyloxy-4-bromo-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-acetyloxy-4-bromobut-2-enoate Traditional Name: (E)-3-acetoxy-4-bromo-but-2-enoic acid methyl ester Formula: C7H9BrO4 MolecularWeight: 237.04796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(=CC(=O)OC)CBr

Isomeric SMILES

CC(=O)O/C(=C/C(=O)OC)/CBr

InChI

InChI=1S/C7H9BrO4/c1-5(9)12-6(4-8)3-7(10)11-2/h3H,4H2,1-2H3/b6-3+