[3-[3-(dihydroxyboranyl)-5-nitro-phenyl]carbonyloxyphenyl]boronic acid

Systemtic Name: [3-[3-(dihydroxyboranyl)-5-nitro-phenyl]carbonyloxyphenyl]boronic acid Openeye Name: [3-(3-borono-5-nitro-benzoyl)oxyphenyl]boronic acid CAS Name: [3-[(3-borono-5-nitrophenyl)-oxomethoxy]phenyl]boronic acid IUPAC Name: [3-(3-borono-5-nitrobenzoyl)oxyphenyl]boronic acid Traditional Name: [3-(3-borono-5-nitro-benzoyl)oxyphenyl]boronic acid Formula: C13H11B2NO8 MolecularWeight: 330.85034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC=C1)OC(=O)C2=CC(=CC(=C2)B(O)O)[N+](=O)[O-])(O)O

Isomeric SMILES

B(C1=CC(=CC=C1)OC(=O)C2=CC(=CC(=C2)B(O)O)[N+](=O)[O-])(O)O

InChI

InChI=1S/C13H11B2NO8/c17-13(24-12-3-1-2-9(7-12)14(18)19)8-4-10(15(20)21)6-11(5-8)16(22)23/h1-7,18-21H