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

Systemtic Name: 1,3-bis[4-[4-(3-bromanyl-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-5-phenyl-benzene Openeye Name: 1,3-bis[4-[4-(3-bromo-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-5-phenyl-benzene CAS Name: 1,3-bis[4-[4-(3-bromo-5-phenylphenoxy)phenyl]sulfonylphenoxy]-5-phenylbenzene IUPAC Name: 1,3-bis[4-[4-(3-bromo-5-phenylphenoxy)phenyl]sulfonylphenoxy]-5-phenylbenzene Traditional Name: 1,3-bis[4-[4-(3-bromo-5-phenyl-phenoxy)phenyl]sulfonylphenoxy]-5-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)OC3=CC=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)OC5=CC(=CC(=C5)C6=CC=CC=C6)Br)OC7=CC=C(C=C7)S(=O)(=O)C8=CC=C(C=C8)OC9=CC(=CC(=C9)C1=CC=CC=C1)Br

Isomeric SMILES

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

InChI

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