Ammonium, dibenzyl((3-hydroxy-2-pyridyl)methyl)methyl-, bromide, dimethylcarbamate (ester)
Basic information
- CAS
66902-86-1- Standard SMILES
CN(C)C(=O)Oc1cccnc1C[N+](C)(Cc1ccccc1)Cc1ccccc1.[Br-]- InChIKey
DKCOPUZPPXMXAL-UHFFFAOYSA-M- Molecular formula
- C24H28BrN3O2
- Average molar mass
- 470.4 g/mol
- Monoisotopic mass
- 469.13649
Names & identifiers
- Preferred name
- Ammonium, dibenzyl((3-hydroxy-2-pyridyl)methyl)methyl-, bromide, dimethylcarbamate (ester)
- IUPAC
- dibenzyl-[[3-(dimethylcarbamoyloxy)-2-pyridinyl]methyl]-methylazanium bromide
Names & synonyms
Ro 2-222766902-86-1Dibenzyl((3-hydroxy-2-pyridyl)methyl)methylammonium bromide dimethylcarbamate (ester)Ammonium, dibenzyl((3-hydroxy-2-pyridyl)methyl)methyl-, bromide, dimethylcarbamate (ester)RefChem:319199DTXSID90985559N,N-dibenzyl{3-[(dimethylcarbamoyl)oxy]pyridin-2-yl}-N-methylmethanaminium bromide
Database identifiers
- CAS
66902-86-1- PubChem CID
- 48317
- DTXSID
DTXSID90985559
Properties
Computed structural properties
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 478
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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