Basic information
- Standard SMILES
CCC(=O)Nc1ccccc1C(=O)Oc1ccc(C(=O)CNC(C)C)cc1O- InChIKey
VHNIUXOOPGJDFX-UHFFFAOYSA-N- Molecular formula
- C21H24N2O5
- Average molar mass
- 384.4 g/mol
Names & identifiers
- Preferred name
- 3-Hydroxy-4-(o-propionamidobenzoyloxy)phenyl isopropylaminomethyl ketone
- IUPAC
- [2-hydroxy-4-[2-(propan-2-ylamino)acetyl]phenyl] 2-(propanoylamino)benzoate
Names & synonyms
SCHEMBL11289707VHNIUXOOPGJDFX-UHFFFAOYSA-N3-hydroxy-4-(o-propionamidobenzoyloxy)phenyl isopropylaminomethyl ketone
Database identifiers
- PubChem CID
- 20535334
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 551
Related reactions
4 records
Compound notes
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