[1,2,2-tris(2-methylphenyl)cyclohexyl]oxyboronic acid

Systemtic Name: [1,2,2-tris(2-methylphenyl)cyclohexyl]oxyboronic acid Openeye Name: [1,2,2-tris(o-tolyl)cyclohexoxy]boronic acid CAS Name: [1,2,2-tris(2-methylphenyl)cyclohexyl]oxyboronic acid IUPAC Name: [1,2,2-tris(2-methylphenyl)cyclohexyl]oxyboronic acid Traditional Name: [1,2,2-tris(o-tolyl)cyclohexoxy]boronic acid Formula: C27H31BO3 MolecularWeight: 414.34424

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Descriptors Computed from Structure

Canonical SMILES:

B(O)(O)OC1(CCCCC1(C2=CC=CC=C2C)C3=CC=CC=C3C)C4=CC=CC=C4C

Isomeric SMILES

B(O)(O)OC1(CCCCC1(C2=CC=CC=C2C)C3=CC=CC=C3C)C4=CC=CC=C4C

InChI

InChI=1S/C27H31BO3/c1-20-12-4-7-15-23(20)26(24-16-8-5-13-21(24)2)18-10-11-19-27(26,31-28(29)30)25-17-9-6-14-22(25)3/h4-9,12-17,29-30H,10-11,18-19H2,1-3H3