Basic information
- Standard SMILES
CCN(C(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1- InChIKey
BNVWRPCEDCMLRA-UHFFFAOYSA-N- Molecular formula
- C15H13BrN2O3
- Average molar mass
- 349.18 g/mol
- Monoisotopic mass
- 348.01095
Names & identifiers
- Preferred name
- N-ethyl-2-bromo-5-nitro-N-phenyl-benzamide
- IUPAC
- 2-bromo-N-ethyl-5-nitro-N-phenylbenzamide
Names & synonyms
SCHEMBL6171862BNVWRPCEDCMLRA-UHFFFAOYSA-NAKOS011217591N-ethyl-2-bromo-5-nitro-N-phenyl-benzamide
Database identifiers
- PubChem CID
- 22288552
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 380
Related reactions
3 records
Compound notes
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