[3-(3,3-dimethylbut-1-ynyl)-4-phenylmethoxy-phenyl]boronic acid

Systemtic Name: [3-(3,3-dimethylbut-1-ynyl)-4-phenylmethoxy-phenyl]boronic acid Openeye Name: [4-benzyloxy-3-(3,3-dimethylbut-1-ynyl)phenyl]boronic acid CAS Name: [3-(3,3-dimethylbut-1-ynyl)-4-phenylmethoxyphenyl]boronic acid IUPAC Name: [3-(3,3-dimethylbut-1-ynyl)-4-phenylmethoxyphenyl]boronic acid Traditional Name: [4-benzoxy-3-(3,3-dimethylbut-1-ynyl)phenyl]boronic acid Formula: C19H21BO3 MolecularWeight: 308.17924

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)OCC2=CC=CC=C2)C#CC(C)(C)C)(O)O

Isomeric SMILES

B(C1=CC(=C(C=C1)OCC2=CC=CC=C2)C#CC(C)(C)C)(O)O

InChI

InChI=1S/C19H21BO3/c1-19(2,3)12-11-16-13-17(20(21)22)9-10-18(16)23-14-15-7-5-4-6-8-15/h4-10,13,21-22H,14H2,1-3H3