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Basic information
- Standard SMILES
CCN(CC)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1- InChIKey
PBUGKDDOXFRVEE-UHFFFAOYSA-N- Molecular formula
- C17H17ClN2O4
- Average molar mass
- 348.8 g/mol
Names & identifiers
- Preferred name
- 4-(4-chloro-2-nitrophenoxy)-N,N-diethylbenzamide
- IUPAC
- 4-(4-chloro-2-nitrophenoxy)-N,N-diethylbenzamide
Names & synonyms
SCHEMBL2960330PBUGKDDOXFRVEE-UHFFFAOYSA-NAKOS0084842184-(4-chloro-2-nitrophenoxy)-N,N-diethylbenzamide
Database identifiers
- PubChem CID
- 51149700
Properties
Computed structural propertiesFilling in
- XLogP
- 4.1
- Topological polar surface area
- 75.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 431
Related reactions
6 records
Compound notes
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