CAS 706806-79-3

1-(1,1-Dimethylethyl) (2R)-2-(1-naphthalenylmethyl)-1,2-pyrrolidinedicarboxylate

Description:

1-(1,1-Dimethylethyl) (2R)-2-(1-naphthalenylmethyl)-1,2-pyrrolidinedicarboxylate, identified by its CAS number 706806-79-3, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring with two carboxylate groups and a naphthylmethyl substituent. This compound is typically classified as an ester due to the presence of the carboxylate functional groups. Its molecular structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the presence of the naphthalene moiety, which is known for its biological activity. The tert-butyl group (1,1-dimethylethyl) contributes to the compound's steric bulk, potentially influencing its reactivity and interaction with biological targets. The stereochemistry indicated by the (2R) designation suggests that the compound may exhibit specific spatial arrangements that could affect its pharmacological properties. Overall, this compound's unique structural features may provide insights into its potential uses in various chemical and biological applications.

Formula: C₂₁H₂₅NO₄

InChI: InChI=1S/C21H25NO4/c1-20(2,3)26-19(25)22-13-7-12-21(22,18(23)24)14-16-10-6-9-15-8-4-5-11-17(15)16/h4-6,8-11H,7,12-14H2,1-3H3,(H,23,24)/t21-/m1/s1

InChI key: InChIKey=BWZACKVIUSVDGM-OAQYLSRUSA-N

SMILES: C([C@]1(C(O)=O)N(C(OC(C)(C)C)=O)CCC1)C=2C3=C(C=CC2)C=CC=C3

Synonyms:

• (R)-1-(tert-Butoxycarbonyl)-2-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxylic acid
• 1,2-Pyrrolidinedicarboxylic acid, 2-(1-naphthalenylmethyl)-, 1-(1,1-dimethylethyl) ester, (2R)-
• 1-(1,1-Dimethylethyl) (2R)-2-(1-naphthalenylmethyl)-1,2-pyrrolidinedicarboxylate