Basic information
- Standard SMILES
CC(=O)OCCC1CN(C(C)=O)c2c(NC(=O)C(C)(C)C)c(C)cc(C)c21- InChIKey
POQNSFURIRMSBS-UHFFFAOYSA-N- Molecular formula
- C21H30N2O4
- Average molar mass
- 374.5 g/mol
- Monoisotopic mass
- 374.22055744
Names & identifiers
- Preferred name
- N-[1-Acetyl-3-(2-acetoxyethyl)-4,6-dimethylindolin-7-yl]-2,2-dimethylpropanamide
- IUPAC
- 2-[1-acetyl-7-(2,2-dimethylpropanoylamino)-4,6-dimethyl-2,3-dihydroindol-3-yl]ethyl acetate
Names & synonyms
SCHEMBL5993407POQNSFURIRMSBS-UHFFFAOYSA-NN-[1-Acetyl-3-(2-acetoxyethyl)-4,6-dimethylindolin-7-yl]-2,2-dimethylpropanamide
Database identifiers
- PubChem CID
- 22247306
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 583
Related reactions
3 records
Compound notes
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