Basic information
- Standard SMILES
CC(C)NC(=O)c1cc(Oc2ccccc2)ccc1[N+](=O)[O-]- InChIKey
DZZRNHUJFXCNHW-UHFFFAOYSA-N- Molecular formula
- C16H16N2O4
- Average molar mass
- 300.31 g/mol
Names & identifiers
- Preferred name
- 2-nitro-N-isopropyl-5-phenoxybenzamide
- IUPAC
- 2-nitro-5-phenoxy-N-propan-2-ylbenzamide
Names & synonyms
SCHEMBL4270245DZZRNHUJFXCNHW-UHFFFAOYSA-N2-nitro-N-isopropyl-5-phenoxybenzamide
Database identifiers
- PubChem CID
- 57796898
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 388
Related reactions
6 records
Compound notes
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