1,4-bis[4-[4-(3-bromanyl-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene

Systemtic Name: 1,4-bis[4-[4-(3-bromanyl-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene Openeye Name: 1,4-bis[4-[4-(3-bromo-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene CAS Name: 1,4-bis[4-[4-(3-bromo-5-phenylphenoxy)phenyl]sulfonylphenoxy]-2-phenylbenzene IUPAC Name: 1,4-bis[4-[4-(3-bromo-5-phenylphenoxy)phenyl]sulfonylphenoxy]-2-phenylbenzene Traditional Name: 1,4-bis[4-[4-(3-bromo-5-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=CC(=CC(=C2)Br)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=CC(=C(C=C5)OC6=CC=C(C=C6)S(=O)(=O)C7=CC=C(C=C7)OC8=CC(=CC(=C8)C9=CC=CC=C9)Br)C1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC(=C2)Br)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=CC(=C(C=C5)OC6=CC=C(C=C6)S(=O)(=O)C7=CC=C(C=C7)OC8=CC(=CC(=C8)C9=CC=CC=C9)Br)C1=CC=CC=C1

InChI

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