Basic information
- Standard SMILES
CCOc1ccc(C2ONC(CO)C=C2C)cc1.Cl- InChIKey
VWUDCJKUOBQISD-UHFFFAOYSA-N- Molecular formula
- C14H20ClNO3
- Average molar mass
- 285.76 g/mol
- Monoisotopic mass
- 285.1131712
Names & identifiers
- Preferred name
- 3,6-dihydro-6-(4-ethoxyphenyl)-3-hydroxymethyl-5-methyl-2H-1,2-oxazine hydrochloride
- IUPAC
- [6-(4-ethoxyphenyl)-5-methyl-3,6-dihydro-2H-oxazin-3-yl]methanol;hydrochloride
Names & synonyms
SCHEMBL7411492VWUDCJKUOBQISD-UHFFFAOYSA-N3,6-dihydro-6-(4-ethoxyphenyl)-3-hydroxymethyl-5-methyl-2H-1,2-oxazine hydrochloride
Database identifiers
- PubChem CID
- 18401552
Properties
Computed structural properties
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 285
Related reactions
2 records
Compound notes
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