Basic information
- Standard SMILES
COC(=O)C(c1ccc(OCc2ccc3ccccc3n2)c(OC)c1)C1CCCCCCC1- InChIKey
XMGOHKYVMVZQPO-UHFFFAOYSA-N- Molecular formula
- C28H33NO4
- Average molar mass
- 447.6 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[3-methoxy-4-(quinolin-2-yl-methoxy)phenyl]-2-cyclooctylacetate
- IUPAC
- methyl 2-cyclooctyl-2-[3-methoxy-4-(quinolin-2-ylmethoxy)phenyl]acetate
Names & synonyms
SCHEMBL9430523XMGOHKYVMVZQPO-UHFFFAOYSA-NMethyl 2-[3-methoxy-4-(quinolin-2-yl-methoxy)phenyl]-2-cyclooctylacetate
Database identifiers
- PubChem CID
- 19087806
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 590
Related reactions
1 records
Compound notes
Loading…