Basic information
- Standard SMILES
Cc1cc(NC(=O)C(C)C)c(C2(O)C(=O)c3ccccc3C2=O)cc1C- InChIKey
OVMNHOLEPFJKRO-UHFFFAOYSA-N- Molecular formula
- C21H21NO4
- Average molar mass
- 351.4 g/mol
Names & identifiers
- Preferred name
- N-(2-(2-Hydroxy-1,3-dioxo-2,3-dihydro-1H-inden-2-yl)-4,5-dimethylphenyl)isobutyramide
- IUPAC
- N-[2-(2-hydroxy-1,3-dioxoinden-2-yl)-4,5-dimethylphenyl]-2-methylpropanamide
Names & synonyms
SCHEMBL15642385OVMNHOLEPFJKRO-UHFFFAOYSA-NN-(2-(2-Hydroxy-1,3-dioxo-2,3-dihydro-1H-inden-2-yl)-4,5-dimethylphenyl)isobutyramide
Database identifiers
- PubChem CID
- 71477902
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 83.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 575
Related reactions
1 records
Compound notes
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