BENZOIC ACID, 4-AMINO-2-ETHOXY-, 3-PIPERIDINOPROPYL ESTER, DIHYDROCHLORIDE
[3-ethoxy-4-(3-piperidin-1-ium-1-ylpropoxycarbonyl)phenyl]azanium dichloride
| Molecular Formula | C17H28Cl2N2O3 |
|---|---|
| Molecular Weight | 379.3 g/mol |
| Topological Polar Surface Area | 67.6 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 378.1477 |
| Heavy Atoms | 24 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 100811-88-9 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)[NH3+])C(=O)OCCC[NH+]2CCCCC2.[Cl-].[Cl-] |
| InChIKey | XFSSXIUFZOFTNX-UHFFFAOYSA-N |
📖 Product Overview
BENZOIC ACID, 4-AMINO-2-ETHOXY-, 3-PIPERIDINOPROPYL ESTER, DIHYDROCHLORIDE (CAS: 100811-88-9) is a chemical compound with molecular formula C17H28Cl2N2O3 and molecular weight 379.3 g/mol. Its IUPAC systematic name is [3-ethoxy-4-(3-piperidin-1-ium-1-ylpropoxycarbonyl)phenyl]azanium dichloride.
XFSSXIUFZOFTNX-UHFFFAOYSA-N.
SMILES: CCOC1=C(C=CC(=C1)[NH3+])C(=O)OCCC[NH+]2CCCCC2.[Cl-].[Cl-].
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