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CAS 119730-06-2

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Methoxycarbonylsulfamoyltriethylammoniumhydroxideinnersalt

Description:
Methoxycarbonylsulfamoyltriethylammonium hydroxide inner salt, identified by its CAS number 119730-06-2, is a chemical compound that features a complex structure incorporating a methoxycarbonyl group, a sulfamoyl moiety, and a triethylammonium cation. This compound is typically characterized by its solubility in polar solvents due to the presence of the ammonium group, which enhances its ionic nature. The methoxycarbonyl group contributes to its reactivity, making it useful in various synthetic applications, particularly in organic synthesis and medicinal chemistry. The sulfamoyl group may impart biological activity, suggesting potential applications in pharmaceuticals. Additionally, the inner salt formation indicates that the compound exists in a stable ionic form, which can influence its physical properties, such as melting point and stability under different conditions. Overall, this compound's unique structural features and functional groups make it a subject of interest in both research and industrial applications.
Formula:C46H32N4O2
InChI:InChI=1/C46H32N4O2/c1-52-46(51)33-19-17-32(18-20-33)45-40-27-25-38(49-40)43(30-13-7-3-8-14-30)36-23-21-34(47-36)42(29-11-5-2-6-12-29)35-22-24-37(48-35)44(31-15-9-4-10-16-31)39-26-28-41(45)50-39/h2-28,47,50H,1H3/b42-34-,42-35-,43-36-,43-38-,44-37-,44-39-,45-40-,45-41-
SMILES:COC(=O)c1ccc(cc1)C1=C2C=CC(=N2)C(=c2ccc(=C(c3ccccc3)C3=NC(=C(c4ccccc4)c4ccc1[nH]4)C=C3)[nH]2)c1ccccc1
Synonyms:
  • 5-(4-Methoxycarbonylphenyl)-10,15,20-triphenyl-21H,23H-porphine
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