Ammonium, (2-((1-benzyl-4-carboxy-3-methylpyrazol-5-yl)oxy)ethyl)trimethyl-, iodide, ethyl ester
2-(1-benzyl-4-ethoxycarbonyl-3-methylpyrazol-5-yl)oxyethyl-trimethylazanium iodide
| Molecular Formula | C19H28IN3O3 |
|---|---|
| Molecular Weight | 473.3 g/mol |
| Topological Polar Surface Area | 53.4 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 473.11755 |
| Heavy Atoms | 26 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 19477-45-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(N(N=C1C)CC2=CC=CC=C2)OCC[N+](C)(C)C.[I-] |
| InChIKey | PAKVLLSBOBUJQO-UHFFFAOYSA-M |
📖 Product Overview
Ammonium, (2-((1-benzyl-4-carboxy-3-methylpyrazol-5-yl)oxy)ethyl)trimethyl-, iodide, ethyl ester (CAS: 19477-45-3) is a chemical compound with molecular formula C19H28IN3O3 and molecular weight 473.3 g/mol. Its IUPAC systematic name is 2-(1-benzyl-4-ethoxycarbonyl-3-methylpyrazol-5-yl)oxyethyl-trimethylazanium iodide.
PAKVLLSBOBUJQO-UHFFFAOYSA-M.
SMILES: CCOC(=O)C1=C(N(N=C1C)CC2=CC=CC=C2)OCC[N+](C)(C)C.[I-].
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