Basic information
- CAS
27722-01-6- Standard SMILES
CCOC(C(=O)OCC[NH+](C)CCc1ccccc1)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
WYLUMBNQGVLBAY-UHFFFAOYSA-N- Molecular formula
- C27H32ClNO3
- Average molar mass
- 454 g/mol
- Monoisotopic mass
- 453.2070716
Names & identifiers
- Preferred name
- Acetic acid, 2,2-diphenyl-2-ethoxy-, 2-(methylphenethylamino)ethyl ester, hydrochloride
- IUPAC
- 2-(2-ethoxy-2,2-diphenylacetyl)oxyethyl-methyl-(2-phenylethyl)azanium chloride
Names & synonyms
Acetic acid, 2,2-diphenyl-2-ethoxy-, 2-(methylphenethylamino)ethyl ester, hydrochloride27722-01-6RefChem:1075691Ethoxydiphenylacetic acid 2-(methylphenethylamino)ethyl ester hydrochloride2,2-Diphenyl-2-ethoxy-acetic acid 2-(methylphenethylamino)ethyl ester hydrochloride
Database identifiers
- CAS
27722-01-6- PubChem CID
- 33997
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 487
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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