Basic information
- Standard SMILES
COc1cc(CCc2ccc3c(c2)CCN3)cc(OC)c1OC- InChIKey
SHXXERVBDDJZID-UHFFFAOYSA-N- Molecular formula
- C19H23NO3
- Average molar mass
- 313.4 g/mol
Names & identifiers
- Preferred name
- 5-(3,4,5-Trimethoxyphenethyl)indoline
- IUPAC
- 5-[2-(3,4,5-trimethoxyphenyl)ethyl]-2,3-dihydro-1H-indole
Names & synonyms
SCHEMBL566247SHXXERVBDDJZID-UHFFFAOYSA-N5-(3,4,5-Trimethoxyphenethyl)indoline
Database identifiers
- PubChem CID
- 66726698
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 351
Related reactions
1 records
Compound notes
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