[3-cyano-5-[4-(dioxidanylmethyl)phenyl]phenyl]boronic acid

Systemtic Name: [3-cyano-5-[4-(dioxidanylmethyl)phenyl]phenyl]boronic acid Openeye Name: [3-cyano-5-[4-(hydroperoxymethyl)phenyl]phenyl]boronic acid CAS Name: [3-cyano-5-[4-(hydroperoxymethyl)phenyl]phenyl]boronic acid IUPAC Name: [3-cyano-5-[4-(hydroperoxymethyl)phenyl]phenyl]boronic acid Traditional Name: [3-cyano-5-[4-(hydroperoxymethyl)phenyl]phenyl]boronic acid Formula: C14H12BNO4 MolecularWeight: 269.06038

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC(=C1)C2=CC=C(C=C2)COO)C#N)(O)O

Isomeric SMILES

B(C1=CC(=CC(=C1)C2=CC=C(C=C2)COO)C#N)(O)O

InChI

InChI=1S/C14H12BNO4/c16-8-11-5-13(7-14(6-11)15(17)18)12-3-1-10(2-4-12)9-20-19/h1-7,17-19H,9H2