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CAS 885949-86-0

:

3-(1,3,4,5,6,7-Hexahydro-3-oxo-2H-indazol-2-yl)benzoic acid

Description:
3-(1,3,4,5,6,7-Hexahydro-3-oxo-2H-indazol-2-yl)benzoic acid, with the CAS number 885949-86-0, is a chemical compound characterized by its unique structural features, which include a benzoic acid moiety and a hexahydroindazole derivative. This compound typically exhibits properties associated with both aromatic and heterocyclic compounds, contributing to its potential biological activity. The presence of the carboxylic acid functional group suggests it may engage in hydrogen bonding and ionic interactions, influencing its solubility and reactivity. The hexahydroindazole structure may impart specific stereochemical properties, affecting its interaction with biological targets. Such compounds are often investigated for their pharmacological potential, including anti-inflammatory or anticancer activities. Additionally, the stability of the compound can be influenced by environmental factors such as pH and temperature. Overall, this compound represents a class of organic molecules that may have significant implications in medicinal chemistry and drug development.
Formula:C14H14N2O3
InChI:InChI=1S/C14H14N2O3/c17-13-11-6-1-2-7-12(11)15-16(13)10-5-3-4-9(8-10)14(18)19/h3-5,8,15H,1-2,6-7H2,(H,18,19)
InChI key:InChIKey=BUEKHNSAMPGZHI-UHFFFAOYSA-N
SMILES:O=C1N(NC2=C1CCCC2)C3=CC(C(O)=O)=CC=C3
Synonyms:
  • 3-(1,3,4,5,6,7-Hexahydro-3-oxo-2H-indazol-2-yl)benzoic acid
  • Benzoic acid, 3-(1,3,4,5,6,7-hexahydro-3-oxo-2H-indazol-2-yl)-
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