Basic information
- Standard SMILES
CCOC(=O)CC1=C2C=CCN2c2ccccc2O1- InChIKey
ZQGBWMFGKKQMFG-UHFFFAOYSA-N- Molecular formula
- C15H15NO3
- Average molar mass
- 257.28 g/mol
Names & identifiers
- Preferred name
- Pyrrolo[2,1-c][1,4]benzoxazine-4-acetic acid ethyl ester
- IUPAC
- ethyl 2-(1H-pyrrolo[2,1-c][1,4]benzoxazin-4-yl)acetate
Names & synonyms
SCHEMBL11737505ZQGBWMFGKKQMFG-UHFFFAOYSA-Npyrrolo[2,1-c][1,4]benzoxazine-4-acetic acid ethyl ester
Database identifiers
- PubChem CID
- 54560571
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 427
Related reactions
1 records
Compound notes
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