Acetoxynitazene
| Acetoxynitazene | |
|---|---|
 |
| Salts [] | |
|---|---|
| Acetoxynitazene hydrochloride | |
| Molecular structure via molpic based on CDK |
| Rotamer [] | |
|---|---|
| Conformer structure via 3Dmol.js |
| Physical properties [] | |
|---|---|
| Molecular mass | 410.5 g/mol [1] |
| Predicted LogP | 3.7 [1] |
| Structural Identifiers [] | |
|---|---|
| Molecular formula | C22H26N4O4 [1] |
| IUPAC name | [4-[[1-[2-(diethylamino)ethyl]-5-nitrobenzimidazol-2-yl]methyl]phenyl] acetate [1] |
| SMILES | CCN(CC)CCN1C2=C(C=C(C=C2)[N+](=O)[O-])N=C1CC3=CC=C(C=C3)OC(=O)C [1] |
| InChI | InChI=1S/C22H26N4O4/c1-4-24(5-2)12-13-25-21-11-8-18(26(28)29)15-20(21)23-22(25)14-17-6-9-19(10-7-17)30-16(3)27/h6-11,15H,4-5,12-14H2,1-3H3 [1] |
| InChIKey | YFXUKAOJFVCFLK-UHFFFAOYSA-N [1] |
Acetoxynitazene (also known as Phenol, 4-((1-(2-(diethylamino)ethyl)-5-nitro-1H-benzimidazol-2-yl)methyl)-, 1-acetate, p-Cresol, α-(1-(2-diethylaminoethyl)-5-nitro-2-benzimidazolyl)-, acetate or P-cresol, α-(1-(2-diethylaminoethyl)-5-nitro-2-benzimidazolyl)-, acetate) is a
Chemistry
Salts []
Acetoxynitazene is typically found in the form of its hydrochloride salt.
Stereochemistry []
Acetoxynitazene is a achiral mixture.
See also []
External links []
References []
National Center for Biotechnology Information. PubChem Compound Summary for CID 162623779, Acetoxynitazene. Accessed June 7, 2026. https://pubchem.ncbi.nlm.nih.gov/compound/162623779
U.S. Food and Drug Administration; National Center for Advancing Translational Sciences. Acetoxynitazene. UNII: DH3K5P5S7F. Global Substance Registration System. Accessed June 7, 2026. https://gsrs.ncats.nih.gov/ginas/app/beta/substances/DH3K5P5S7F