ethyl 6-bromanyl-2-methyl-5-methylsulfonyloxy-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2-methyl-5-methylsulfonyloxy-1-benzofuran-3-carboxylate Openeye Name: ethyl 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylate CAS Name: 6-bromo-2-methyl-5-methylsulfonyloxy-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2-methyl-5-methylsulfonyloxy-1-benzofuran-3-carboxylate Traditional Name: 6-bromo-2-methyl-5-methylsulfonyloxy-benzofuran-3-carboxylic acid ethyl ester Formula: C13H13BrO6S MolecularWeight: 377.20772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OS(=O)(=O)C)Br)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=CC(=C(C=C21)OS(=O)(=O)C)Br)C

InChI

InChI=1S/C13H13BrO6S/c1-4-18-13(15)12-7(2)19-10-6-9(14)11(5-8(10)12)20-21(3,16)17/h5-6H,4H2,1-3H3