C 2138
2-(2-methylpiperidin-1-ium-1-yl)ethyl N-ethyl-N-[1-(2-methylphenoxy)propan-2-yl]carbamate chloride
| Molecular Formula | C21H35ClN2O3 |
|---|---|
| Molecular Weight | 399.0 g/mol |
| Topological Polar Surface Area | 43.2 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 398.2336 |
| Heavy Atoms | 27 |
| Complexity | 418.0 |
Chemical Identifiers
| CAS Number | 101491-84-3 |
|---|---|
| SMILES | CCN(C(C)COC1=CC=CC=C1C)C(=O)OCC[NH+]2CCCCC2C.[Cl-] |
| InChIKey | KMHSEXZIHDSEGW-UHFFFAOYSA-N |
📖 Product Overview
C 2138 (CAS: 101491-84-3) is a chemical compound with molecular formula C21H35ClN2O3 and molecular weight 399.0 g/mol. Its IUPAC systematic name is 2-(2-methylpiperidin-1-ium-1-yl)ethyl N-ethyl-N-[1-(2-methylphenoxy)propan-2-yl]carbamate chloride.
KMHSEXZIHDSEGW-UHFFFAOYSA-N.
SMILES: CCN(C(C)COC1=CC=CC=C1C)C(=O)OCC[NH+]2CCCCC2C.[Cl-].
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