Basic information
- CAS
82935-30-6- Standard SMILES
CCOc1ccc(Br)c(OCC)c1C(=O)NC[C@@H]1CCC[NH+]1CC.[Cl-]- InChIKey
SDFPILKXAAHRFN-ZOWNYOTGSA-N- Molecular formula
- C18H28BrClN2O3
- Average molar mass
- 435.8 g/mol
- Monoisotopic mass
- 434.09718
Names & identifiers
- Preferred name
- Benzamide, 3-bromo-2,6-diethoxy-N-(1-ethyl-2-pyrrolidinylmethyl)-, monohydrochloride, (S)-(-)-
- IUPAC
- 3-bromo-2,6-diethoxy-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]benzamide chloride
Names & synonyms
(S)-(-)-2-((3-Bromo-2,6-diethoxybenzamido)methyl)-1-ethylpyrrolidine hydrochloride(S)-(-)-3-Bromo-2,6-diethoxy-N-(1-ethyl-2-pyrrolidinylmethyl)benzamide hydrochlorideBenzamide, 3-bromo-2,6-diethoxy-N-(1-ethyl-2-pyrrolidinylmethyl)-, monohydrochloride, (S)-(-)-RefChem:32153482935-30-6
Database identifiers
- CAS
82935-30-6- PubChem CID
- 54945
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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