[4-[1-(2-nitroimidazol-2-yl)ethyl]phenyl]boronic acid

Systemtic Name: [4-[1-(2-nitroimidazol-2-yl)ethyl]phenyl]boronic acid Openeye Name: [4-[1-(2-nitroimidazol-2-yl)ethyl]phenyl]boronic acid CAS Name: [4-[1-(2-nitro-2-imidazolyl)ethyl]phenyl]boronic acid IUPAC Name: [4-[1-(2-nitroimidazol-2-yl)ethyl]phenyl]boronic acid Traditional Name: [4-[1-(2-nitroimidazol-2-yl)ethyl]phenyl]boronic acid Formula: C11H12BN3O4 MolecularWeight: 261.04168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(C)C2(N=CC=N2)[N+](=O)[O-])(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(C)C2(N=CC=N2)[N+](=O)[O-])(O)O

InChI

InChI=1S/C11H12BN3O4/c1-8(11(15(18)19)13-6-7-14-11)9-2-4-10(5-3-9)12(16)17/h2-8,16-17H,1H3