(5-bromanyl-2-propanoyl-phenyl) methanesulfonate

Systemtic Name: (5-bromanyl-2-propanoyl-phenyl) methanesulfonate Openeye Name: (5-bromo-2-propanoyl-phenyl) methanesulfonate CAS Name: methanesulfonic acid [5-bromo-2-(1-oxopropyl)phenyl] ester IUPAC Name: (5-bromo-2-propanoylphenyl) methanesulfonate Traditional Name: methanesulfonic acid (5-bromo-2-propionyl-phenyl) ester Formula: C10H11BrO4S MolecularWeight: 307.16094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C=C(C=C1)Br)OS(=O)(=O)C

Isomeric SMILES

CCC(=O)C1=C(C=C(C=C1)Br)OS(=O)(=O)C

InChI

InChI=1S/C10H11BrO4S/c1-3-9(12)8-5-4-7(11)6-10(8)15-16(2,13)14/h4-6H,3H2,1-2H3