Basic information
- CAS
3114-90-7- Standard SMILES
CCOC(C(=O)OCCC1CCC[NH+]1CC)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
NEVXYHLGSWSGFO-UHFFFAOYSA-N- Molecular formula
- C24H32ClNO3
- Average molar mass
- 418 g/mol
- Monoisotopic mass
- 417.2070716
Names & identifiers
- Preferred name
- Acetic acid, 2,2-diphenyl-2-ethoxy-, 2-(1-ethyl-2-pyrrolidinyl)ethyl ester, hydrochloride
- IUPAC
- 2-(1-ethylpyrrolidin-1-ium-2-yl)ethyl 2-ethoxy-2,2-diphenylacetate chloride
Names & synonyms
Acetic acid, 2,2-diphenyl-2-ethoxy-, 2-(1-ethyl-2-pyrrolidinyl)ethyl ester, hydrochloride3114-90-7RefChem:10756902,2-Diphenyl-2-ethoxyacetic acid 2-(1-ethyl-2-pyrrolidinyl)ethyl ester hydrochloride
Database identifiers
- CAS
3114-90-7- PubChem CID
- 18375
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 450
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…