About 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine
3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine (PubChem CID 160907553) has the molecular formula C80H67NO14S3
and a molecular weight of 1362.61 g/mol. Its IUPAC name is 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine.
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Frequently Asked Questions
What is the IUPAC name of 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine?
The IUPAC name of 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine (CID 160907553) is 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine.
What is the SMILES notation for 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine?
The canonical SMILES for 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine is COc1ccc(-c2ccc(-c3ccc(Oc4ccc(S(=O)(=O)c5ccc(Oc6c(C)cc(-c7cc(C)c(OC)c(C)c7)cc6C)cc5)cc4)cc3)nc2)cc1.Cc1ccc(S(=O)(=O)c2ccc(Oc3cc(Oc4ccc(S(=O)(=O)c5ccc(C)cc5)cc4)cc(C(=O)O)c3)cc2)cc1.
What is the InChIKey of 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine?
The InChIKey is SQIPQNHCBQZWPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C47H41NO6S.C33H26O8S2/c1-30-25-37(26-31(2)46(30)52-6)38-27-32(3)47(33(4)28-38)54-42-18-22-44(23-19-42)55(49,50)43-20-16-41(17-21-43)53-40-14-9-35(10-15-40)45-24-11-36(29-48-45)34-7-12-39(51-5)13-8-34;1-22-3-11-29(12-4-22)42(36,37)31-15-7-25(8-16-31)40-27-19-24(33(34)35)20-28(21-27)41-26-9-17-32(18-10-26)43(38,39)30-13-5-23(2)6-14-30/h7-29H,1-6H3;3-21H,1-2H3,(H,34,35).
What are the key properties of 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine?
3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine has a molecular weight of 1362.61 g/mol, XLogP of 19.00, 20 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis[4-(4-methylphenyl)sulfonylphenoxy]benzoic acid;2-[4-[4-[4-[4-(4-methoxy-3,5-dimethylphenyl)-2,6-dimethylphenoxy]phenyl]sulfonylphenoxy]phenyl]-5-(4-methoxyphenyl)pyridine is sourced from PubChem (CID 160907553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).