Basic information
- CAS
5497-40-5- Standard SMILES
CC[NH+](CC)CC(C)OC(=O)C(c1ccc(OC)cc1)c1ccc(OC)cc1.[Cl-]- InChIKey
XNMPIXFUHUEKDE-UHFFFAOYSA-N- Molecular formula
- C23H32ClNO4
- Average molar mass
- 422 g/mol
- Monoisotopic mass
- 421.2019862
Names & identifiers
- Preferred name
- Acetic acid, bis(p-methoxyphenyl)-, 2-(diethylamino)-1-methylethyl ester, hydrochloride
- IUPAC
- 2-[2,2-bis(4-methoxyphenyl)acetyl]oxypropyl-diethylazanium chloride
Names & synonyms
Acetic acid, bis(p-methoxyphenyl)-, 2-(diethylamino)-1-methylethyl ester, hydrochloride5497-40-5RefChem:1075765IEM 457Bis(p-methoxyphenyl)acetic acid 2-(diethylamino)-1-methylethyl ester hydrochloride
Database identifiers
- CAS
5497-40-5- PubChem CID
- 21664
Properties
Computed structural properties
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…