Basic information
- CAS
4061-36-3- Standard SMILES
Cc1cccc(Cl)c1NC(=O)C[N+](C)(C)CC(=O)Nc1ccccc1.[Cl-]- InChIKey
PDEKURUQTKBWKN-UHFFFAOYSA-N- Molecular formula
- C19H23Cl2N3O2
- Average molar mass
- 396.3 g/mol
- Monoisotopic mass
- 395.1167324
Names & identifiers
- Preferred name
- Ammonium, (((6-chloro-o-tolyl)carbamoyl)methyl)dimethyl((phenylcarbamoyl)methyl)-, chloride
- IUPAC
- (2-anilino-2-oxoethyl)-[2-(2-chloro-6-methylanilino)-2-oxoethyl]-dimethylazanium chloride
Names & synonyms
Ammonium, (((6-chloro-o-tolyl)carbamoyl)methyl)dimethyl((phenylcarbamoyl)methyl)-, chloride(((6-Chloro-o-tolyl)carbamoyl)methyl)dimethyl((phenylcarbamoyl)methyl)ammonium chloride4061-36-3RefChem:318607
Database identifiers
- CAS
4061-36-3- PubChem CID
- 19979
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
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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