Basic information
- Standard SMILES
Cc1cccc(Cl)c1NC(=O)Nc1ccc([N+](=O)[O-])cc1O- InChIKey
ZGBWDCCQBAHGGC-UHFFFAOYSA-N- Molecular formula
- C14H12ClN3O4
- Average molar mass
- 321.71 g/mol
Names & identifiers
- Preferred name
- N-(2-hydroxy-4-nitrophenyl) N'-(2-chloro 6-methylphenyl)urea
- IUPAC
- 1-(2-chloro-6-methylphenyl)-3-(2-hydroxy-4-nitrophenyl)urea
Names & synonyms
SCHEMBL5595057ZGBWDCCQBAHGGC-UHFFFAOYSA-NN-(2-hydroxy-4-nitrophenyl) N'-(2-chloro 6-methylphenyl)ureaN-(2-hydroxy-4-nitro phenvl) N'-(2-chloro 6-methyl phenyl) ureaN-(2-hydroxy-4-nitro phenyl) N'-(2-chloro 6-methyl phenyl) urea
Database identifiers
- PubChem CID
- 19595671
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 107 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 417
Related reactions
6 records
Compound notes
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