Basic information
- Standard SMILES
N#Cc1ccc(COc2ccc(-n3ccc4ccccc43)cc2)cc1- InChIKey
ZFFLWEBSXISDMF-UHFFFAOYSA-N- Molecular formula
- C22H16N2O
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- 1-{4-[(4-cyanobenzyl)oxy]phenyl}-1H-indole
- IUPAC
- 4-[(4-indol-1-ylphenoxy)methyl]benzonitrile
Names & synonyms
SCHEMBL3196812ZFFLWEBSXISDMF-UHFFFAOYSA-N1-{4-[(4-cyanobenzyl)oxy]phenyl}-1H-indole
Database identifiers
- PubChem CID
- 68545969
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 38 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 468
Related reactions
3 records
Compound notes
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