Basic information
- Standard SMILES
COC(=O)C(C)(Oc1ccc(Oc2cnc3ccccc3n2)cc1)C(=O)OC- InChIKey
JEMIAGYSULPPAG-UHFFFAOYSA-N- Molecular formula
- C20H18N2O6
- Average molar mass
- 382.4 g/mol
Names & identifiers
- Preferred name
- Dimethyl 2-methyl-2-[4-(2-quinoxalinyloxy)phenoxy]propanedioate
- IUPAC
- dimethyl 2-methyl-2-(4-quinoxalin-2-yloxyphenoxy)propanedioate
Names & synonyms
SCHEMBL10906880JEMIAGYSULPPAG-UHFFFAOYSA-NDimethyl 2-methyl-2-[4-(2-quinoxalinyloxy)phenoxy]propanedioate
Database identifiers
- PubChem CID
- 20236282
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 96.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 533
Related reactions
2 records
Compound notes
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