[4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]boronic acid

Systemtic Name: [4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]boronic acid Openeye Name: [4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]boronic acid CAS Name: [4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]boronic acid IUPAC Name: [4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]boronic acid Traditional Name: [4-[4-(3,7-dimethyloctoxy)phenyl]phenyl]boronic acid Formula: C22H31BO3 MolecularWeight: 354.29074

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C2=CC=C(C=C2)OCCC(C)CCCC(C)C)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C2=CC=C(C=C2)OCCC(C)CCCC(C)C)(O)O

InChI

InChI=1S/C22H31BO3/c1-17(2)5-4-6-18(3)15-16-26-22-13-9-20(10-14-22)19-7-11-21(12-8-19)23(24)25/h7-14,17-18,24-25H,4-6,15-16H2,1-3H3