Basic information
- Standard SMILES
CNC(=O)c1cccc(Oc2ccc(N)c([N+](=O)[O-])c2)c1- InChIKey
BSYILNKPVKURNJ-UHFFFAOYSA-N- Molecular formula
- C14H13N3O4
- Average molar mass
- 287.27 g/mol
- Monoisotopic mass
- 287.0906059
Names & identifiers
- Preferred name
- 3-(4-amino-3-nitro-phenoxy)-N-methyl-benzamide
- IUPAC
- 3-(4-amino-3-nitrophenoxy)-N-methylbenzamide
Names & synonyms
SCHEMBL4364884BSYILNKPVKURNJ-UHFFFAOYSA-N3-(4-amino-3-nitro-phenoxy)-N-methyl-benzamide
Database identifiers
- PubChem CID
- 69017532
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 385
Related reactions
5 records
Compound notes
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