Basic information
- CAS
109691-07-8- Standard SMILES
CC[NH+](CC)CC(OC(=O)COc1ccccc1)c1ccccc1.[Cl-]- InChIKey
MWHAVBLZLGSQAC-UHFFFAOYSA-N- Molecular formula
- C20H26ClNO3
- Average molar mass
- 363.9 g/mol
- Monoisotopic mass
- 363.1601214
Names & identifiers
- Preferred name
- Acetic acid, phenoxy-, alpha-((diethylamino)methyl)benzyl ester, hydrochloride
- IUPAC
- diethyl-[2-(2-phenoxyacetyl)oxy-2-phenylethyl]azanium chloride
Names & synonyms
109691-07-8ACETIC ACID, PHENOXY-, alpha-((DIETHYLAMINO)METHYL)BENZYL ESTER, HYDROCHLORIDERefChem:1075833Phenoxyacetic acid alpha-((diethylamino)methyl)benzyl ester hydrochloridediethyl-[2-(2-phenoxyacetyl)oxy-2-phenylethyl]azanium;chlorideACETIC ACID, PHENOXY-, alpha-((DIETHYLAMINO)METHYL)BENZYL ESTER, HYDRO CHLORIDE
Database identifiers
- CAS
109691-07-8- PubChem CID
- 60362
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 345
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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