CAS 32392-58-8

(2R)-2-[(3aR,4S,7S,7aS)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]propanoate

Description:

The chemical substance with the name "(2R)-2-[(3aR,4S,7S,7aS)-1,3-dioxooctahydro-2H-4,7-methanoisoindol-2-yl]propanoate" and CAS number "32392-58-8" is a complex organic compound characterized by its specific stereochemistry and functional groups. It features a propanoate moiety, indicating the presence of an ester functional group, which is typically associated with moderate polarity and potential for solubility in organic solvents. The compound also contains a dioxo structure, suggesting the presence of carbonyl groups that can participate in various chemical reactions, including nucleophilic attacks and hydrogen bonding. The bicyclic structure derived from the methanoisoindole framework contributes to its rigidity and potential biological activity. The stereochemical descriptors (2R, 3aR, 4S, 7S, 7aS) indicate that the compound has multiple chiral centers, which can significantly influence its pharmacological properties and interactions with biological targets. Overall, this compound may exhibit unique chemical reactivity and biological activity, making it of interest in medicinal chemistry and drug development.

Formula: C₁₂H₁₅NO₄

InChI: InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6+,7+,8-,9+/m1/s1

InChI key: REFMTLIXGKZVDF-UHFFFAOYSA-N

SMILES: CC(C(=O)O)N1C(=O)C2C3CCC(C3)C2C1=O

Synonyms:

• 2-(3,5-DIOXO-4-AZA-TRICYCLO[5.2.1.0(2,6)]DEC-4-YL)-PROPIONIC ACID
• 2-(1,3-Dioxohexahydro-1H-4,7-methanoisoindol-2(3H)-yl)propanoic acid
• 4,7-Methano-2H-isoindole-2-acetic acid, octahydro-α-methyl-1,3-dioxo-
• 2-(3,5-DIOXO-4-AZA-TRICYCLO[5.2.1.0]DEC-4-YL)-PROPIONIC ACID
• 2-(1,3-Dioxooctahydro-2H-4,7-methanoisoindol-2-yl)propanoic acid