Basic information
- Standard SMILES
CCC(Oc1ccc(C(C)(C)CC)cc1C(C)(C)CC)C(=O)Nc1cc(Cl)c(N)c([N+](=O)[O-])c1O- InChIKey
DRNYLKOJUKWOTR-UHFFFAOYSA-N- Molecular formula
- C26H36ClN3O5
- Average molar mass
- 506 g/mol
Names & identifiers
- Preferred name
- 3-Amino-4-chloro-2-nitro-6-[2-(2,4-di-t-amylphenoxy)butanoylamino]phenol
- IUPAC
- N-(4-amino-5-chloro-2-hydroxy-3-nitrophenyl)-2-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanamide
Names & synonyms
SCHEMBL9814161DRNYLKOJUKWOTR-UHFFFAOYSA-N3-amino-4-chloro-2-nitro-6-[2-(2,4-di-t-amylphenoxy)butanoylamino]phenol
Database identifiers
- PubChem CID
- 20137815
Properties
Computed structural properties
- XLogP
- 8.7
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 728
Related reactions
1 records
Compound notes
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