Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCOC(=O)C(=O)c1c[nH]c2c(C(C)C)cc(Br)cc12- InChIKey
DSYYRDSGCRUZPI-UHFFFAOYSA-N- Molecular formula
- C15H16BrNO3
- Average molar mass
- 338.2 g/mol
Names & identifiers
- Preferred name
- Ethyl 2-(5-Bromo-7-isopropyl-1H-indol-3-yl)-2-oxoacetate
- IUPAC
- ethyl 2-(5-bromo-7-propan-2-yl-1H-indol-3-yl)-2-oxoacetate
Names & synonyms
SCHEMBL4805445DSYYRDSGCRUZPI-UHFFFAOYSA-NEthyl 2-(5 -bromo-7-isopropyl-1H-indol-3-yl)-2-oxoacetateEthyl 2-(5-Bromo-7-isopropyl-1H-indol-3-yl)-2-oxoacetate
Database identifiers
- PubChem CID
- 59639726
Properties
Computed structural propertiesFilling in
- XLogP
- 4
- Topological polar surface area
- 59.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 385
Related reactions
2 records
Compound notes
Loading…