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

Systemtic Name: [3-(diethylcarbamoyl)-5-nitro-phenyl]boronic acid Openeye Name: [3-(diethylcarbamoyl)-5-nitro-phenyl]boronic acid CAS Name: [3-[diethylamino(oxo)methyl]-5-nitrophenyl]boronic acid IUPAC Name: [3-(diethylcarbamoyl)-5-nitrophenyl]boronic acid Traditional Name: [3-(diethylcarbamoyl)-5-nitro-phenyl]boronic acid Formula: C11H15BN2O5 MolecularWeight: 266.0582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15BN2O5/c1-3-13(4-2)11(15)8-5-9(12(16)17)7-10(6-8)14(18)19/h5-7,16-17H,3-4H2,1-2H3