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

Systemtic Name: 1,3-bis[4-[4-(3-bromanyl-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene Openeye Name: 1,3-bis[4-[4-(3-bromo-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-2-phenyl-benzene CAS Name: 1,3-bis[4-[4-(3-bromo-5-phenylphenoxy)phenyl]sulfonylphenoxy]-2-phenylbenzene IUPAC Name: 1,3-bis[4-[4-(3-bromo-5-phenylphenoxy)phenyl]sulfonylphenoxy]-2-phenylbenzene Traditional Name: 1,3-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=C(C(=CC=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=C(C(=CC=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/c61-46-35-44(41-11-4-1-5-12-41)37-52(39-46)67-48-19-27-54(28-20-48)71(63,64)56-31-23-50(24-32-56)69-58-17-10-18-59(60(58)43-15-8-3-9-16-43)70-51-25-33-57(34-26-51)72(65,66)55-29-21-49(22-30-55)68-53-38-45(36-47(62)40-53)42-13-6-2-7-14-42/h1-40H