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

Systemtic Name: [4-[(2-nitroimidazol-1-yl)methyl]phenyl]boronic acid Openeye Name: [4-[(2-nitroimidazol-1-yl)methyl]phenyl]boronic acid CAS Name: [4-[(2-nitro-1-imidazolyl)methyl]phenyl]boronic acid IUPAC Name: [4-[(2-nitroimidazol-1-yl)methyl]phenyl]boronic acid Traditional Name: [4-[(2-nitroimidazol-1-yl)methyl]phenyl]boronic acid Formula: C10H10BN3O4 MolecularWeight: 247.0151

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)CN2C=CN=C2[N+](=O)[O-])(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)CN2C=CN=C2[N+](=O)[O-])(O)O

InChI

InChI=1S/C10H10BN3O4/c15-11(16)9-3-1-8(2-4-9)7-13-6-5-12-10(13)14(17)18/h1-6,15-16H,7H2