5-Chloro-2-hydroxy-3-nitro-N-[3-(2-phenylethoxy)phenyl]benzamide
Basic information
- CAS
648923-57-3- Standard SMILES
O=C(Nc1cccc(OCCc2ccccc2)c1)c1cc(Cl)cc([N+](=O)[O-])c1O- InChIKey
YFMHJWXPVGOQAA-UHFFFAOYSA-N- Molecular formula
- C21H17ClN2O5
- Average molar mass
- 412.8 g/mol
- Monoisotopic mass
- 412.0825993
Names & identifiers
- Preferred name
- 5-Chloro-2-hydroxy-3-nitro-N-[3-(2-phenylethoxy)phenyl]benzamide
- IUPAC
- 5-chloro-2-hydroxy-3-nitro-N-[3-(2-phenylethoxy)phenyl]benzamide
Names & synonyms
5-Chloro-2-hydroxy-3-nitro-N-[3-(2-phenylethoxy)phenyl]benzamide648923-57-3SCHEMBL13812670DTXSID00727740
Database identifiers
- CAS
648923-57-3- PubChem CID
- 57721738
- DTXSID
DTXSID00727740
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 552
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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