Basic information
- CAS
4061-34-1- Standard SMILES
Cc1cccc(C)c1NC(=O)C[N+](C)(C)CC(=O)Nc1ccccc1.[Cl-]- InChIKey
JUYMNMWBPMSAPQ-UHFFFAOYSA-N- Molecular formula
- C20H26ClN3O2
- Average molar mass
- 375.9 g/mol
- Monoisotopic mass
- 375.1713548
Names & identifiers
- Preferred name
- Ammonium, dimethyl((phenylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride
- IUPAC
- (2-anilino-2-oxoethyl)-[2-(2,6-dimethylanilino)-2-oxoethyl]-dimethylazanium chloride
Names & synonyms
4061-34-1Dimethyl((phenylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)ammonium chlorideAmmonium, dimethyl((phenylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chlorideRefChem:319296
Database identifiers
- CAS
4061-34-1- PubChem CID
- 19975
Properties
Computed structural properties
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 448
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…