[4-[4-[bis(3-methylbutan-2-yl)boranyl]butyl]-2,6-dimethoxy-phenyl] 2,2-dimethylpropanoate

Systemtic Name: [4-[4-[bis(3-methylbutan-2-yl)boranyl]butyl]-2,6-dimethoxy-phenyl] 2,2-dimethylpropanoate Openeye Name: [4-[4-[bis(1,2-dimethylpropyl)boranyl]butyl]-2,6-dimethoxy-phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[4-[bis(3-methylbutan-2-yl)boranyl]butyl]-2,6-dimethoxyphenyl] ester IUPAC Name: [4-[4-[bis(3-methylbutan-2-yl)boranyl]butyl]-2,6-dimethoxyphenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[4-[bis(1,2-dimethylpropyl)boranyl]butyl]-2,6-dimethoxy-phenyl] ester Formula: C27H47BO4 MolecularWeight: 446.47068

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Descriptors Computed from Structure

Canonical SMILES:

B(CCCCC1=CC(=C(C(=C1)OC)OC(=O)C(C)(C)C)OC)(C(C)C(C)C)C(C)C(C)C

Isomeric SMILES

B(CCCCC1=CC(=C(C(=C1)OC)OC(=O)C(C)(C)C)OC)(C(C)C(C)C)C(C)C(C)C

InChI

InChI=1S/C27H47BO4/c1-18(2)20(5)28(21(6)19(3)4)15-13-12-14-22-16-23(30-10)25(24(17-22)31-11)32-26(29)27(7,8)9/h16-21H,12-15H2,1-11H3