Basic information
- Standard SMILES
COc1ccc(CC(=O)c2ccc3c(c2)N(C)C(=O)CO3)c(Cl)c1- InChIKey
GMRRZNXIJNNVOY-UHFFFAOYSA-N- Molecular formula
- C18H16ClNO4
- Average molar mass
- 345.8 g/mol
Names & identifiers
- Preferred name
- 6-[2-(2-chloro-4-methoxy-phenyl)-acetyl]-4-methyl-4H-benzo[1,4]oxazin-3-one
- IUPAC
- 6-[2-(2-chloro-4-methoxyphenyl)acetyl]-4-methyl-1,4-benzoxazin-3-one
Names & synonyms
SCHEMBL474428GMRRZNXIJNNVOY-UHFFFAOYSA-N6-[2-(2-chloro-4-methoxy-phenyl)-acetyl]-4-methyl-4H-benzo[1,4]oxazin-3-one
Database identifiers
- PubChem CID
- 66697252
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 486
Related reactions
5 records
Compound notes
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