[4-[4-(oxan-2-yloxymethyl)-2,6-dipropoxy-phenyl]phenyl]boronic acid

Systemtic Name: [4-[4-(oxan-2-yloxymethyl)-2,6-dipropoxy-phenyl]phenyl]boronic acid Openeye Name: [4-[2,6-dipropoxy-4-(tetrahydropyran-2-yloxymethyl)phenyl]phenyl]boronic acid CAS Name: [4-[4-(2-oxanyloxymethyl)-2,6-dipropoxyphenyl]phenyl]boronic acid IUPAC Name: [4-[4-(oxan-2-yloxymethyl)-2,6-dipropoxyphenyl]phenyl]boronic acid Traditional Name: [4-[2,6-dipropoxy-4-(tetrahydropyran-2-yloxymethyl)phenyl]phenyl]boronic acid Formula: C24H33BO6 MolecularWeight: 428.32622

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C2=C(C=C(C=C2OCCC)COC3CCCCO3)OCCC)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C2=C(C=C(C=C2OCCC)COC3CCCCO3)OCCC)(O)O

InChI

InChI=1S/C24H33BO6/c1-3-12-28-21-15-18(17-31-23-7-5-6-14-30-23)16-22(29-13-4-2)24(21)19-8-10-20(11-9-19)25(26)27/h8-11,15-16,23,26-27H,3-7,12-14,17H2,1-2H3