Basic information
- Standard SMILES
COc1ccc(Oc2c(C)cc([N+](=O)[O-])cc2C)cc1C(=O)c1ccc(F)cc1- InChIKey
LSHPNPIBGPCHCT-UHFFFAOYSA-N- Molecular formula
- C22H18FNO5
- Average molar mass
- 395.4 g/mol
Names & identifiers
- Preferred name
- (4-Fluorophenyl)[2-methoxy-5-(2,6-dimethyl-4-nitrophenoxy)phenyl]methanone
- IUPAC
- [5-(2,6-dimethyl-4-nitrophenoxy)-2-methoxyphenyl]-(4-fluorophenyl)methanone
Names & synonyms
SCHEMBL4961806LSHPNPIBGPCHCT-UHFFFAOYSA-N(4-fluorophenyl)[2-methoxy-5-(2,6-dimethyl-4-nitrophenoxy)phenyl]methanone(4-fluorophenyl)[2-methoxy-5-(2,6-dimethyl-4nitrophenoxy) phenyl]methanone(4-fluorophenyl)[2-methoxy-5-(2,6-dimethyl-4-nitrophenoxy) phenyl]methanone(4-fluorophenyl)[2-methoxy-5-(2,6-dimethyl-4-nitrophenoxy)phenyl]-methanone[5-(2,6-Dimethyl-4-nitro-phenoxy)-2-methoxy-phenyl]-(4-fluoro-phenyl)-methanone
Database identifiers
- PubChem CID
- 10046205
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 81.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 562
Related reactions
19 records
Compound notes
Loading…