Basic information
- Standard SMILES
CCOC(=O)C(C)(C)Oc1cccc2c1ccn2CCCCl- InChIKey
DLGBTRHXHNXUOE-UHFFFAOYSA-N- Molecular formula
- C17H22ClNO3
- Average molar mass
- 323.8 g/mol
Names & identifiers
- Preferred name
- 2-[1-(3-chloropropyl)-1H-indol-4-yloxy]-2-methylpropionic acid ethyl ester
- IUPAC
- ethyl 2-[1-(3-chloropropyl)indol-4-yl]oxy-2-methylpropanoate
Names & synonyms
SCHEMBL4240009DLGBTRHXHNXUOE-UHFFFAOYSA-N2-[1-(3-chloropropyl)-1H-indol-4-yloxy]-2-methylpropionic acid ethyl ester
Database identifiers
- PubChem CID
- 16090873
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 375
Related reactions
4 records
Compound notes
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