[3-(2,6-dimethylphenyl)-4-phenylmethoxy-phenyl]boronic acid

Systemtic Name: [3-(2,6-dimethylphenyl)-4-phenylmethoxy-phenyl]boronic acid Openeye Name: [4-benzyloxy-3-(2,6-dimethylphenyl)phenyl]boronic acid CAS Name: [3-(2,6-dimethylphenyl)-4-phenylmethoxyphenyl]boronic acid IUPAC Name: [3-(2,6-dimethylphenyl)-4-phenylmethoxyphenyl]boronic acid Traditional Name: [4-benzoxy-3-(2,6-dimethylphenyl)phenyl]boronic acid Formula: C21H21BO3 MolecularWeight: 332.20064

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(C=CC=C3C)C)(O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=C(C=CC=C3C)C)(O)O

InChI

InChI=1S/C21H21BO3/c1-15-7-6-8-16(2)21(15)19-13-18(22(23)24)11-12-20(19)25-14-17-9-4-3-5-10-17/h3-13,23-24H,14H2,1-2H3