Ammonium, dimethyl(2-hydroxy-3-(1-naphthyloxy)propyl)((mesitylcarbamoyl)methyl)-, chloride
Basic information
- CAS
87415-54-1- Standard SMILES
Cc1cc(C)c(NC(=O)C[N+](C)(C)CC(O)COc2cccc3ccccc23)c(C)c1.[Cl-]- InChIKey
UDBUPAOLIXWSFM-UHFFFAOYSA-N- Molecular formula
- C26H33ClN2O3
- Average molar mass
- 457 g/mol
- Monoisotopic mass
- 456.2179706
Names & identifiers
- Preferred name
- Ammonium, dimethyl(2-hydroxy-3-(1-naphthyloxy)propyl)((mesitylcarbamoyl)methyl)-, chloride
- IUPAC
- (2-hydroxy-3-naphthalen-1-yloxypropyl)-dimethyl-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]azanium chloride
Names & synonyms
Ammonium, dimethyl(2-hydroxy-3-(1-naphthyloxy)propyl)((mesitylcarbamoyl)methyl)-, chloride87415-54-1Dimethyl(2-hydroxy-3-(1-naphthyloxy)propyl)((mesitylcarbamoyl)methyl)ammonium chlorideRefChem:319307MLS000710554SMR000280321CHEMBL1387500HMS2636H20HMS3361L15ST50320287[2-hydroxy-3-(naphthalen-1-yloxy)propyl]dimethyl{[(2,4,6-trimethylphenyl)carbamoyl]methyl}azanium chloride
Database identifiers
- CAS
87415-54-1- PubChem CID
- 55704
- ChEMBL
CHEMBL1387500
Properties
Computed structural properties
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 569
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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