1,1,2,2,3,3,4,4-octakis-phenylbutane-1,4-diol

Systemtic Name: 1,1,2,2,3,3,4,4-octakis-phenylbutane-1,4-diol Openeye Name: 1,1,2,2,3,3,4,4-octakis-phenylbutane-1,4-diol CAS Name: 1,1,2,2,3,3,4,4-octakis-phenylbutane-1,4-diol IUPAC Name: 1,1,2,2,3,3,4,4-octakis-phenylbutane-1,4-diol Traditional Name: 1,1,2,2,3,3,4,4-octakis-phenylbutane-1,4-diol Formula: C52H42O2 MolecularWeight: 698.88868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)O)C(C7=CC=CC=C7)(C8=CC=CC=C8)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C(C3=CC=CC=C3)(C4=CC=CC=C4)C(C5=CC=CC=C5)(C6=CC=CC=C6)O)C(C7=CC=CC=C7)(C8=CC=CC=C8)O

InChI

InChI=1S/C52H42O2/c53-51(45-33-17-5-18-34-45,46-35-19-6-20-36-46)49(41-25-9-1-10-26-41,42-27-11-2-12-28-42)50(43-29-13-3-14-30-43,44-31-15-4-16-32-44)52(54,47-37-21-7-22-38-47)48-39-23-8-24-40-48/h1-40,53-54H