[3-[2,4-bis(chloranyl)-6-nitro-phenoxy]carbonyl-5-nitro-phenyl]boronic acid

Systemtic Name: [3-[2,4-bis(chloranyl)-6-nitro-phenoxy]carbonyl-5-nitro-phenyl]boronic acid Openeye Name: [3-(2,4-dichloro-6-nitro-phenoxy)carbonyl-5-nitro-phenyl]boronic acid CAS Name: [3-[(2,4-dichloro-6-nitrophenoxy)-oxomethyl]-5-nitrophenyl]boronic acid IUPAC Name: [3-(2,4-dichloro-6-nitrophenoxy)carbonyl-5-nitrophenyl]boronic acid Traditional Name: [3-(2,4-dichloro-6-nitro-phenoxy)carbonyl-5-nitro-phenyl]boronic acid Formula: C13H7BCl2N2O8 MolecularWeight: 400.92028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7BCl2N2O8/c15-8-4-10(16)12(11(5-8)18(24)25)26-13(19)6-1-7(14(20)21)3-9(2-6)17(22)23/h1-5,20-21H