Basic information
- Standard SMILES
COC(=O)c1ccccc1OCCN1CCC(c2c[nH]c3ccccc23)CC1- InChIKey
WLIZJZBJHVKCLV-UHFFFAOYSA-N- Molecular formula
- C23H26N2O3
- Average molar mass
- 378.5 g/mol
Names & identifiers
- Preferred name
- methyl 2-{2-[4-(1H-indol-3-yl)-piperidin-1-yl]-ethoxy}-benzoate
- IUPAC
- methyl 2-[2-[4-(1H-indol-3-yl)piperidin-1-yl]ethoxy]benzoate
Names & synonyms
2-(2-[4-(1H-indol-3-yl)-piperidin-1-yl]-ethoxy}-benzoic acid methyl ester2-{2-[4-(1H-indol-3-yl)-piperidin-1-yl]-ethoxy}-benzoic acid methyl esterSCHEMBL5345178WLIZJZBJHVKCLV-UHFFFAOYSA-Nmethyl 2-{2-[4-(1H-indol-3-yl)-piperidin-1-yl]-ethoxy}-benzoate
Database identifiers
- PubChem CID
- 11440344
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 54.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 506
Related reactions
19 records
Compound notes
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