Basic information
- Standard SMILES
COC(=O)C(C)Oc1cccc2c1cc(C)n2Cc1ccccc1- InChIKey
PFJOHYMDZCJWOV-UHFFFAOYSA-N- Molecular formula
- C20H21NO3
- Average molar mass
- 323.4 g/mol
Names & identifiers
- Preferred name
- 2-[[2-methyl-1-(phenylmethyl)-1H-indol-4-yl]oxy]propanoic acid methyl ester
- IUPAC
- methyl 2-(1-benzyl-2-methylindol-4-yl)oxypropanoate
Names & synonyms
SCHEMBL2165494PFJOHYMDZCJWOV-UHFFFAOYSA-N2-[[2-methyl-1-(phenylmethyl)-1H-indol-4-yl]oxy]propanoic acid methyl ester
Database identifiers
- PubChem CID
- 10639652
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 421
Related reactions
10 records
Compound notes
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