Basic information
- CAS
66902-88-3- Standard SMILES
CC(=O)c1c(C)c(C(C)C[N+](C)(C)Cc2ccc(Cl)cc2Cl)c2ccccn12.[Cl-]- InChIKey
OSNVOXSAPFOFOC-UHFFFAOYSA-M- Molecular formula
- C23H27Cl3N2O
- Average molar mass
- 453.8 g/mol
- Monoisotopic mass
- 452.118897
Names & identifiers
- Preferred name
- Ammonium, (2,4-dichlorobenzyl)dimethyl(2-(3-acetyl-2-methyl-1-indolizinyl)-2-methylethyl)-, chloride
- IUPAC
- 2-(3-acetyl-2-methylindolizin-1-yl)propyl-[(2,4-dichlorophenyl)methyl]-dimethylazanium chloride
Names & synonyms
66902-88-3Ammonium, (2,4-dichlorobenzyl)dimethyl(2-(3-acetyl-2-methyl-1-indolizinyl)-2-methylethyl)-, chlorideRefChem:318692DTXSID609855612-(3-Acetyl-2-methylindolizin-1-yl)-N-[(2,4-dichlorophenyl)methyl]-N,N-dimethylpropan-1-aminium chloride
Database identifiers
- CAS
66902-88-3- PubChem CID
- 48321
- DTXSID
DTXSID60985561
Properties
Computed structural properties
- Topological polar surface area
- 21.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 555
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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