Basic information
- Standard SMILES
CCc1cc(CC(=O)OC)ccc1OCc1ccc2ccccc2n1- InChIKey
RDMQCUZKNCRXPM-UHFFFAOYSA-N- Molecular formula
- C21H21NO3
- Average molar mass
- 335.4 g/mol
Names & identifiers
- Preferred name
- Methyl 2-[3-ethyl-4-(quinolin-2-yl-methoxy)phenyl]acetate
- IUPAC
- methyl 2-[3-ethyl-4-(quinolin-2-ylmethoxy)phenyl]acetate
Names & synonyms
SCHEMBL9430715RDMQCUZKNCRXPM-UHFFFAOYSA-NMethyl 2-[3-ethyl-4-(quinolin-2-yl-methoxy)phenyl]acetate
Database identifiers
- PubChem CID
- 19087796
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 48.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 427
Related reactions
2 records
Compound notes
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