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

Systemtic Name: [3-(3-methylphenoxy)carbonyl-5-nitro-phenyl]boronic acid Openeye Name: [3-(3-methylphenoxy)carbonyl-5-nitro-phenyl]boronic acid CAS Name: [3-[(3-methylphenoxy)-oxomethyl]-5-nitrophenyl]boronic acid IUPAC Name: [3-(3-methylphenoxy)carbonyl-5-nitrophenyl]boronic acid Traditional Name: [3-(3-methylphenoxy)carbonyl-5-nitro-phenyl]boronic acid Formula: C14H12BNO6 MolecularWeight: 301.05918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12BNO6/c1-9-3-2-4-13(5-9)22-14(17)10-6-11(15(18)19)8-12(7-10)16(20)21/h2-8,18-19H,1H3