Abstract
Nitro-1H-benzotriazole derivatives containing electron withdrawing substitutents in the ortho and meta positions to the nitro group have been synthesized by the simple and direct nitration of the parent 1H-benzotriazoles. The route of nitration and assignment of isomerism in these compounds is proposed based upon high level density functional theory (DFT) calculations.
Original language | English |
---|---|
Pages (from-to) | 1461-1470 |
Number of pages | 10 |
Journal | Heterocycles |
Volume | 57 |
Issue number | 8 |
DOIs | |
Publication status | Published - 2002 |
Externally published | Yes |
Keywords
- PREPARATION
- Nitration
- 1H-benzotriazole
- isomerism
- DFT
- Chemistry
- Organic Chemistry
- Analytical Chemistry
- Pharmacology