1,4-bis[4-[4-(4-bromanyl-2-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene

Systemtic Name: 1,4-bis[4-[4-(4-bromanyl-2-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene Openeye Name: 1,4-bis[4-[4-(4-bromo-2-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene CAS Name: 1,4-bis[4-[4-(4-bromo-2-phenylphenoxy)phenyl]sulfonylphenoxy]-2-phenylbenzene IUPAC Name: 1,4-bis[4-[4-(4-bromo-2-phenylphenoxy)phenyl]sulfonylphenoxy]-2-phenylbenzene Traditional Name: 1,4-bis[4-[4-(4-bromo-2-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene Formula: C60H40Br2O8S2 MolecularWeight: 1112.8928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=CC(=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=C(C=C(C=C5)Br)C6=CC=CC=C6)OC7=CC=C(C=C7)S(=O)(=O)C8=CC=C(C=C8)OC9=C(C=C(C=C9)Br)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=CC(=C2)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=C(C=C(C=C5)Br)C6=CC=CC=C6)OC7=CC=C(C=C7)S(=O)(=O)C8=CC=C(C=C8)OC9=C(C=C(C=C9)Br)C1=CC=CC=C1

InChI

InChI=1S/C60H40Br2O8S2/c61-44-16-35-58(55(38-44)41-10-4-1-5-11-41)68-47-20-29-52(30-21-47)71(63,64)51-27-18-46(19-28-51)67-50-26-37-60(57(40-50)43-14-8-3-9-15-43)70-49-24-33-54(34-25-49)72(65,66)53-31-22-48(23-32-53)69-59-36-17-45(62)39-56(59)42-12-6-2-7-13-42/h1-40H