Ouiioinztcllee-uhfffaoysa-
Basic information
- CAS
23789-87-9- Standard SMILES
CCOC(=O)c1cn(CC)c2ccccc2c1=O- InChIKey
OUIIOINZTCLLEE-UHFFFAOYSA-N- Molecular formula
- C14H15NO3
- Average molar mass
- 245.27 g/mol
- Monoisotopic mass
- 245.10519334
Names & identifiers
- Preferred name
- Ouiioinztcllee-uhfffaoysa-
- IUPAC
- ethyl 1-ethyl-4-oxoquinoline-3-carboxylate
Names & synonyms
OUIIOINZTCLLEE-UHFFFAOYSA-SCHEMBL7056985ethyl 1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylateAKOS000280515InChI=1/C14H15NO3/c1-3-15-9-11(14(17)18-4-2)13(16)10-7-5-6-8-12(10)15/h5-9H,3-4H2,1-2H3
Database identifiers
- CAS
23789-87-9- PubChem CID
- 4437201
- Nikkaji
- J777.353F
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 375
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Compound notes
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