[3-(dimethylcarbamoyl)-5-nitro-phenyl]boronic acid

Systemtic Name: [3-(dimethylcarbamoyl)-5-nitro-phenyl]boronic acid Openeye Name: [3-(dimethylcarbamoyl)-5-nitro-phenyl]boronic acid CAS Name: [3-[dimethylamino(oxo)methyl]-5-nitrophenyl]boronic acid IUPAC Name: [3-(dimethylcarbamoyl)-5-nitrophenyl]boronic acid Traditional Name: [3-(dimethylcarbamoyl)-5-nitro-phenyl]boronic acid Formula: C9H11BN2O5 MolecularWeight: 238.00504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11BN2O5/c1-11(2)9(13)6-3-7(10(14)15)5-8(4-6)12(16)17/h3-5,14-15H,1-2H3