Basic information
- Standard SMILES
CC(C)C(C(=O)OC(C#N)c1cccc(Oc2ccccc2)n1)c1ccc2ccccc2c1- InChIKey
UCUHNUVDIALLAZ-UHFFFAOYSA-N- Molecular formula
- C28H24N2O3
- Average molar mass
- 436.5 g/mol
Names & identifiers
- Preferred name
- Cyano(6-phenoxy-2-pyridyl)methyl 2-(2-naphthyl)-3-methylbutanoate
- IUPAC
- [cyano-(6-phenoxy-2-pyridinyl)methyl] 3-methyl-2-naphthalen-2-ylbutanoate
Names & synonyms
SCHEMBL11462142UCUHNUVDIALLAZ-UHFFFAOYSA-Ncyano(6-phenoxy-2-pyridyl)methyl 2-(2-naphthyl)-3-methylbutanoate
Database identifiers
- PubChem CID
- 54346705
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 72.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 680
Related reactions
2 records
Compound notes
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