(3,5-dimethoxy-4-methylsulfanyl-phenoxy)boronic acid

Systemtic Name: (3,5-dimethoxy-4-methylsulfanyl-phenoxy)boronic acid Openeye Name: (3,5-dimethoxy-4-methylsulfanyl-phenoxy)boronic acid CAS Name: [3,5-dimethoxy-4-(methylthio)phenoxy]boronic acid IUPAC Name: (3,5-dimethoxy-4-methylsulfanylphenoxy)boronic acid Traditional Name: [3,5-dimethoxy-4-(methylthio)phenoxy]boronic acid Formula: C9H13BO5S MolecularWeight: 244.07252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)OC1=CC(=C(C(=C1)OC)SC)OC

Isomeric SMILES

B(O)(O)OC1=CC(=C(C(=C1)OC)SC)OC

InChI

InChI=1S/C9H13BO5S/c1-13-7-4-6(15-10(11)12)5-8(14-2)9(7)16-3/h4-5,11-12H,1-3H3