Basic information
- CAS
2740-16-1- Standard SMILES
CC[NH+](CC)CCCOC(=O)C(OC)(c1ccccc1)c1ccccc1.[Cl-]- InChIKey
JVFFLRLPEXLPQT-UHFFFAOYSA-N- Molecular formula
- C22H30ClNO3
- Average molar mass
- 391.9 g/mol
- Monoisotopic mass
- 391.1914215
Overview
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Names & identifiers
- Preferred name
- Acetic acid, 2,2-diphenyl-2-methoxy-, (3-(diethylamino)propyl) ester, hydrochloride
- IUPAC
- diethyl-[3-(2-methoxy-2,2-diphenylacetyl)oxypropyl]azanium chloride
Names & synonyms
Acetic acid, 2,2-diphenyl-2-methoxy-, (3-(diethylamino)propyl) ester, hydrochloride2,2-Diphenyl-2-methoxyacetic acid (3-(diethylamino)propyl) ester hydrochloride
Database identifiers
- CAS
2740-16-1- PubChem CID
- 17658
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
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Compound notes
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