Basic information
- Standard SMILES
CCOC(=O)C(=O)N(c1ccccc1)c1c(C(C)C)cccc1C(C)C- InChIKey
ZVSWKCALEMMYNV-UHFFFAOYSA-N- Molecular formula
- C22H27NO3
- Average molar mass
- 353.5 g/mol
Names & identifiers
- Preferred name
- N-(2,6-Diisopropylphenyl)-oxanilic acid ethyl ester
- IUPAC
- ethyl 2-(N-[2,6-di(propan-2-yl)phenyl]anilino)-2-oxoacetate
Names & synonyms
SCHEMBL3159839ZVSWKCALEMMYNV-UHFFFAOYSA-NN-(2,6-Diisopropylphenyl)-oxanilic acid ethyl ester
Database identifiers
- PubChem CID
- 68533759
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 452
Related reactions
4 records
Compound notes
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