Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
COC(=O)Cn1c2c(ccc1=O)C(=O)CCC2- InChIKey
YUJLUUCKKSPXMN-UHFFFAOYSA-N- Molecular formula
- C12H13NO4
- Average molar mass
- 235.24 g/mol
- Monoisotopic mass
- 235.0844579
Names & identifiers
- Preferred name
- 1-Methoxycarbonylmethyl-7,8-dihydro-2,5(1H,6H)-quinolinedione
- IUPAC
- methyl 2-(2,5-dioxo-7,8-dihydro-6H-quinolin-1-yl)acetate
Names & synonyms
SCHEMBL9802719YUJLUUCKKSPXMN-UHFFFAOYSA-NAKOS0196783261-Methoxycarbonylmethyl-7,8-dihydro-2,5(1H,6H)-quinolinedione
Database identifiers
- PubChem CID
- 19986002
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 63.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 447
Related reactions
4 records
Compound notes
Loading…