2-chloro-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
Basic information
- CAS
6057-43-8- Standard SMILES
O=C(NCCNc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1Cl- InChIKey
HKJUOCQTZYGQQL-UHFFFAOYSA-N- Molecular formula
- C15H13Cl2N3O3
- Average molar mass
- 354.2 g/mol
- Monoisotopic mass
- 353.0333967
Names & identifiers
- Preferred name
- 2-chloro-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
- IUPAC
- 2-chloro-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamide
Names & synonyms
2-chloro-N-[2-(2-chloro-4-nitroanilino)ethyl]benzamideSTK0462666057-43-82-chloro-N-{2-[(2-chloro-4-nitrophenyl)amino]ethyl}benzamideCBMicro_007319Cambridge id 6057438DTXSID50387191SMSF0012216AKOS000424251CB09727BIM-0007246.P001AB00102255-01
Show more names
330835-46-6
Database identifiers
- CAS
6057-43-8- PubChem CID
- 2883441
- DTXSID
DTXSID50387191
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 419
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Related reactions
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Compound notes
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