Basic information
- Standard SMILES
Cc1cc2c(OCC(=O)OCc3ccccc3)cccc2[nH]1- InChIKey
NDTVFIJBGYWHPV-UHFFFAOYSA-N- Molecular formula
- C18H17NO3
- Average molar mass
- 295.3 g/mol
Names & identifiers
- Preferred name
- (2-Methyl-1H-indol-4-yloxy)-acetic acid benzyl ester
- IUPAC
- benzyl 2-[(2-methyl-1H-indol-4-yl)oxy]acetate
Names & synonyms
SCHEMBL3207672NDTVFIJBGYWHPV-UHFFFAOYSA-N(2-Methyl-1H-indol-4-yloxy)-acetic acid benzyl ester
Database identifiers
- PubChem CID
- 58765424
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 367
Related reactions
3 records
Compound notes
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