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

Systemtic Name: 1,3-bis[4-[4-(3-bromanyl-5-methyl-phenoxy)phenyl]sulfonylphenoxy]-5-methyl-benzene Openeye Name: 1,3-bis[4-[4-(3-bromo-5-methyl-phenoxy)phenyl]sulfonylphenoxy]-5-methyl-benzene CAS Name: 1,3-bis[4-[4-(3-bromo-5-methylphenoxy)phenyl]sulfonylphenoxy]-5-methylbenzene IUPAC Name: 1,3-bis[4-[4-(3-bromo-5-methylphenoxy)phenyl]sulfonylphenoxy]-5-methylbenzene Traditional Name: 1,3-bis[4-[4-(3-bromo-5-methyl-phenoxy)phenyl]sulfonylphenoxy]-5-methyl-benzene Formula: C45H34Br2O8S2 MolecularWeight: 926.68466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC(=CC(=C4)C)Br)OC5=CC=C(C=C5)S(=O)(=O)C6=CC=C(C=C6)OC7=CC(=CC(=C7)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)OC4=CC(=CC(=C4)C)Br)OC5=CC=C(C=C5)S(=O)(=O)C6=CC=C(C=C6)OC7=CC(=CC(=C7)C)Br

InChI

InChI=1S/C45H34Br2O8S2/c1-29-20-32(46)26-38(22-29)52-34-4-12-42(13-5-34)56(48,49)44-16-8-36(9-17-44)54-40-24-31(3)25-41(28-40)55-37-10-18-45(19-11-37)57(50,51)43-14-6-35(7-15-43)53-39-23-30(2)21-33(47)27-39/h4-28H,1-3H3