Basic information
- CAS
26058-58-2- Standard SMILES
CC[N+](C)(CC)CCNC(=O)C(O)(c1ccccc1)c1cccs1.[Br-]- InChIKey
IVAUISLBFCUDQN-UHFFFAOYSA-N- Molecular formula
- C19H27BrN2O2S
- Average molar mass
- 427.4 g/mol
- Monoisotopic mass
- 426.09766
Names & identifiers
- Preferred name
- Ammonium, diethyl(2-(alpha-hydroxy-alpha-phenyl-2-thiopheneacetamido)ethyl)methyl-, bromide
- IUPAC
- diethyl-[2-[(2-hydroxy-2-phenyl-2-thiophen-2-ylacetyl)amino]ethyl]-methylazanium bromide
Names & synonyms
FC 21726058-58-2Ammonium, diethyl(2-(alpha-hydroxy-alpha-phenyl-2-thiopheneacetamido)ethyl)methyl-, bromideRefChem:319212
Database identifiers
- CAS
26058-58-2- PubChem CID
- 33284
Properties
Computed structural properties
- Topological polar surface area
- 77.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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