[3-nitro-5-(4-nitrophenoxy)carbonyl-phenyl]boronic acid

Systemtic Name: [3-nitro-5-(4-nitrophenoxy)carbonyl-phenyl]boronic acid Openeye Name: [3-nitro-5-(4-nitrophenoxy)carbonyl-phenyl]boronic acid CAS Name: [3-nitro-5-[(4-nitrophenoxy)-oxomethyl]phenyl]boronic acid IUPAC Name: [3-nitro-5-(4-nitrophenoxy)carbonylphenyl]boronic acid Traditional Name: [3-nitro-5-(4-nitrophenoxy)carbonyl-phenyl]boronic acid Formula: C13H9BN2O8 MolecularWeight: 332.03016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9BN2O8/c17-13(24-12-3-1-10(2-4-12)15(20)21)8-5-9(14(18)19)7-11(6-8)16(22)23/h1-7,18-19H