Basic information
- Standard SMILES
Cc1[nH]c2ccc(O)cc2c1C(=O)OCc1ccccc1- InChIKey
FFYWSFXDFVCJPG-UHFFFAOYSA-N- Molecular formula
- C17H15NO3
- Average molar mass
- 281.3 g/mol
Names & identifiers
- Preferred name
- 5-Hydroxy-2-methyl-1H-indole-3-carboxylic acid benzyl ester
- IUPAC
- benzyl 5-hydroxy-2-methyl-1H-indole-3-carboxylate
Names & synonyms
SCHEMBL6315808FFYWSFXDFVCJPG-UHFFFAOYSA-N2-Methyl-3-benzyloxycarbonyl-5-hydroxyindole5-Hydroxy-2-methyl-1H-indole-3-carboxylic acid benzyl ester
Database identifiers
- PubChem CID
- 10923975
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 367
Related reactions
14 records
Compound notes
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