(3-nitro-5-phenoxycarbonyl-phenyl)boronic acid

Systemtic Name: (3-nitro-5-phenoxycarbonyl-phenyl)boronic acid Openeye Name: (3-nitro-5-phenoxycarbonyl-phenyl)boronic acid CAS Name: [3-nitro-5-[oxo(phenoxy)methyl]phenyl]boronic acid IUPAC Name: (3-nitro-5-phenoxycarbonylphenyl)boronic acid Traditional Name: (3-carbophenoxy-5-nitro-phenyl)boronic acid Formula: C13H10BNO6 MolecularWeight: 287.0326

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OC2=CC=CC=C2)(O)O

InChI

InChI=1S/C13H10BNO6/c16-13(21-12-4-2-1-3-5-12)9-6-10(14(17)18)8-11(7-9)15(19)20/h1-8,17-18H