CAS 97885-49-9

1,1-Dimethylethyl (2S)-2-[[(4-nitrophenyl)amino]carbonyl]-1-pyrrolidinecarboxylate

Description:

1,1-Dimethylethyl (2S)-2-[[(4-nitrophenyl)amino]carbonyl]-1-pyrrolidinecarboxylate, with the CAS number 97885-49-9, is a chemical compound characterized by its complex structure, which includes a pyrrolidine ring and a nitrophenyl group. This compound features a carboxylate functional group, contributing to its potential reactivity and solubility in various solvents. The presence of the nitrophenyl moiety suggests that it may exhibit significant electronic properties, potentially influencing its interactions in biological systems or chemical reactions. The dimethyl substituents on the carbon chain enhance steric hindrance, which can affect the compound's conformation and reactivity. As a chiral molecule, it may exist in different stereoisomeric forms, with the (2S) configuration indicating a specific spatial arrangement of its atoms. This compound may be of interest in medicinal chemistry and drug development due to its structural features, which could impart biological activity. However, specific applications and safety considerations would depend on further research and characterization.

Formula: C₁₆H₂₁N₃O₅

InChI: InChI=1S/C16H21N3O5/c1-16(2,3)24-15(21)18-10-4-5-13(18)14(20)17-11-6-8-12(9-7-11)19(22)23/h6-9,13H,4-5,10H2,1-3H3,(H,17,20)/t13-/m0/s1

InChI key: InChIKey=MGSPREPYCVTJKZ-ZDUSSCGKSA-N

SMILES: C(NC1=CC=C(N(=O)=O)C=C1)(=O)[C@H]2N(C(OC(C)(C)C)=O)CCC2

Synonyms:

• 1-Pyrrolidinecarboxylic acid, 2-[[(4-nitrophenyl)amino]carbonyl]-, 1,1-dimethylethyl ester, (2S)-
• 1-Pyrrolidinecarboxylic acid, 2-[[(4-nitrophenyl)amino]carbonyl]-, 1,1-dimethylethyl ester, (S)-
• 1,1-Dimethylethyl (2S)-2-[[(4-nitrophenyl)amino]carbonyl]-1-pyrrolidinecarboxylate