Basic information
- Standard SMILES
Cc1cc([N+](=O)[O-])c(NCC(=O)[O-])cc1Cl.[Na+]- InChIKey
SIOWYDWNZOIOSR-UHFFFAOYSA-M- Molecular formula
- C9H8ClN2NaO4
- Average molar mass
- 266.61 g/mol
- Monoisotopic mass
- 266.0070287
Names & identifiers
- Preferred name
- n-(5'-Chloro-4'-methyl-2'-nitrophenyl)glycine sodium salt
- IUPAC
- sodium 2-(5-chloro-4-methyl-2-nitroanilino)acetate
Names & synonyms
SCHEMBL7786653SIOWYDWNZOIOSR-UHFFFAOYSA-Mn-(5'-chloro-4'-methyl-2'-nitrophenyl)glycine sodium salt
Database identifiers
- PubChem CID
- 21190047
Properties
Computed structural properties
- Topological polar surface area
- 98 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 276
Related reactions
4 records
Compound notes
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