Basic information
- Standard SMILES
N=C(N)OCCc1ccc(Oc2ccc(Cl)c(C(F)(F)F)c2)cc1- InChIKey
SNBIEAOOVLXEDG-UHFFFAOYSA-N- Molecular formula
- C16H14ClF3N2O2
- Average molar mass
- 358.74 g/mol
- Monoisotopic mass
- 358.0695899
Names & identifiers
- Preferred name
- 2-(4-{[4-Chloro-3-(trifluoromethyl)phenyl]oxy}phenyl)ethyl imidocarbamate
- IUPAC
- 2-[4-[4-chloro-3-(trifluoromethyl)phenoxy]phenyl]ethyl carbamimidate
Names & synonyms
2-(4-{[4-chloro-3-(trifluoromethyl)phenyl]oxy}phenyl)ethyl imidocarbamateSCHEMBL91080702-(4-{[4-chloro-3-(trifluoromethyl)phenyl]oxy}-phenyl)ethyl imidocarbamate
Database identifiers
- PubChem CID
- 67775904
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 415
Related reactions
6 records
Compound notes
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