[2-[(2-butoxyphenyl)carbamoyloxy]-3-pyrrolidin-1-ium-1-ylpropyl]-diethylazanium dichloride
[2-[(2-butoxyphenyl)carbamoyloxy]-3-pyrrolidin-1-ium-1-ylpropyl]-diethylazanium dichloride
| Molecular Formula | C22H39Cl2N3O3 |
|---|---|
| Molecular Weight | 464.5 g/mol |
| Topological Polar Surface Area | 56.4 A2 |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 463.23685 |
| Heavy Atoms | 30 |
| Complexity | 425.0 |
Chemical Identifiers
| CAS Number | 105404-38-4 |
|---|---|
| SMILES | CCCCOC1=CC=CC=C1NC(=O)OC(C[NH+]2CCCC2)C[NH+](CC)CC.[Cl-].[Cl-] |
| InChIKey | DVUGMXTYVZSYBZ-UHFFFAOYSA-N |
📖 Product Overview
[2-[(2-butoxyphenyl)carbamoyloxy]-3-pyrrolidin-1-ium-1-ylpropyl]-diethylazanium dichloride (CAS: 105404-38-4) is a chemical compound with molecular formula C22H39Cl2N3O3 and molecular weight 464.5 g/mol. Its IUPAC systematic name is [2-[(2-butoxyphenyl)carbamoyloxy]-3-pyrrolidin-1-ium-1-ylpropyl]-diethylazanium dichloride.
DVUGMXTYVZSYBZ-UHFFFAOYSA-N.
SMILES: CCCCOC1=CC=CC=C1NC(=O)OC(C[NH+]2CCCC2)C[NH+](CC)CC.[Cl-].[Cl-].
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