Ammonium, dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride
Basic information
- CAS
4169-33-9- Standard SMILES
Cc1ccccc1NC(=O)C[N+](C)(C)CC(=O)Nc1c(C)cccc1C.[Cl-]- InChIKey
YSKADTNXEBAWKW-UHFFFAOYSA-N- Molecular formula
- C21H28ClN3O2
- Average molar mass
- 389.9 g/mol
- Monoisotopic mass
- 389.1870048
Names & identifiers
- Preferred name
- Ammonium, dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride
- IUPAC
- [2-(2,6-dimethylanilino)-2-oxoethyl]-dimethyl-[2-(2-methylanilino)-2-oxoethyl]azanium chloride
Names & synonyms
Ammonium, dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)-, chloride4169-33-9Dimethyl((o-tolylcarbamoyl)methyl)((2,6-xylylcarbamoyl)methyl)ammonium chlorideRefChem:319295
Database identifiers
- CAS
4169-33-9- PubChem CID
- 20130
Properties
Computed structural properties
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 482
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Compound notes
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