Ethyl 3-(5-methoxy-2-methylindol-3-yl)-4,4,4-trifluorobutanoate
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Basic information
- Standard SMILES
CCOC(=O)CC(c1c(C)[nH]c2ccc(OC)cc12)C(F)(F)F- InChIKey
FGGHZOCFLUEWJB-UHFFFAOYSA-N- Molecular formula
- C16H18F3NO3
- Average molar mass
- 329.31 g/mol
Names & identifiers
- Preferred name
- Ethyl 3-(5-methoxy-2-methylindol-3-yl)-4,4,4-trifluorobutanoate
- IUPAC
- ethyl 4,4,4-trifluoro-3-(5-methoxy-2-methyl-1H-indol-3-yl)butanoate
Names & synonyms
Ethyl 3-(5-methoxy-2-methylindol-3-yl)-4,4,4-trifluorobutanoateSCHEMBL8877049
Database identifiers
- PubChem CID
- 19974941
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 416
Related reactions
2 records
Compound notes
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