Basic information
- Standard SMILES
CCOC(=O)C(=Cc1cccc2[nH]ccc12)OCC- InChIKey
KFEUOBAMPAOOQW-UHFFFAOYSA-N- Molecular formula
- C15H17NO3
- Average molar mass
- 259.3 g/mol
- Monoisotopic mass
- 259.1208434
Names & identifiers
- Preferred name
- ethyl 2-ethoxy-3-(1H-indol-4-yl)prop-2-enoate
- IUPAC
- ethyl 2-ethoxy-3-(1H-indol-4-yl)prop-2-enoate
Names & synonyms
SCHEMBL5017640
Database identifiers
- PubChem CID
- 69280562
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 51.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 340
Related reactions
1 records
Compound notes
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