(4-chloranyl-2-ethoxycarbonyl-phenyl)boronic acid

Systemtic Name: (4-chloranyl-2-ethoxycarbonyl-phenyl)boronic acid Openeye Name: (4-chloro-2-ethoxycarbonyl-phenyl)boronic acid CAS Name: (4-chloro-2-ethoxycarbonylphenyl)boronic acid IUPAC Name: (4-chloro-2-ethoxycarbonylphenyl)boronic acid Traditional Name: (2-carbethoxy-4-chloro-phenyl)boronic acid Formula: C9H10BClO4 MolecularWeight: 228.4373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=C(C=C(C=C1)Cl)C(=O)OCC)(O)O

Isomeric SMILES

B(C1=C(C=C(C=C1)Cl)C(=O)OCC)(O)O

InChI

InChI=1S/C9H10BClO4/c1-2-15-9(12)7-5-6(11)3-4-8(7)10(13)14/h3-5,13-14H,2H2,1H3