dimethyl 5-(bromomethyl)-1-benzothiophene-2,3-dicarboxylate

Systemtic Name: dimethyl 5-(bromomethyl)-1-benzothiophene-2,3-dicarboxylate Openeye Name: dimethyl 5-(bromomethyl)benzothiophene-2,3-dicarboxylate CAS Name: 5-(bromomethyl)-1-benzothiophene-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(bromomethyl)-1-benzothiophene-2,3-dicarboxylate Traditional Name: 5-(bromomethyl)benzothiophene-2,3-dicarboxylic acid dimethyl ester Formula: C13H11BrO4S MolecularWeight: 343.19304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1C=C(C=C2)CBr)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC2=C1C=C(C=C2)CBr)C(=O)OC

InChI

InChI=1S/C13H11BrO4S/c1-17-12(15)10-8-5-7(6-14)3-4-9(8)19-11(10)13(16)18-2/h3-5H,6H2,1-2H3