(4R)-4-p-toluenesulfonyloxy-2-[4-(4-methoxyphenyl)phenyl]decanenitrile
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Basic information
- Standard SMILES
CCCCCC[C@H](CC(C#N)c1ccc(-c2ccc(OC)cc2)cc1)OS(=O)(=O)c1ccc(C)cc1- InChIKey
MOYMESFBTFVLOQ-ZBAATNBSSA-N- Molecular formula
- C30H35NO4S
- Average molar mass
- 505.7 g/mol
Names & identifiers
- Preferred name
- (4R)-4-p-toluenesulfonyloxy-2-[4-(4-methoxyphenyl)phenyl]decanenitrile
- IUPAC
- [(3R)-1-cyano-1-[4-(4-methoxyphenyl)phenyl]nonan-3-yl] 4-methylbenzenesulfonate
Names & synonyms
SCHEMBL9348602MOYMESFBTFVLOQ-ZBAATNBSSA-N(4R)-4-p-toluenesulfonyloxy-2-[4-(4-methoxyphenyl)phenyl]decanenitrile
Database identifiers
- PubChem CID
- 54083752
Properties
Computed structural propertiesFilling in
- XLogP
- 7.9
- Topological polar surface area
- 84.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 13
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 761
Related reactions
1 records
Compound notes
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