Basic information
- CAS
66902-45-2- Standard SMILES
C[NH+]1CCC(CCOC(=O)C(c2ccccc2)c2ccccc2)CC1.[Cl-]- InChIKey
GPXZZSWGMITNCO-UHFFFAOYSA-N- Molecular formula
- C22H28ClNO2
- Average molar mass
- 373.9 g/mol
- Monoisotopic mass
- 373.1808568
Names & identifiers
- Preferred name
- 2-(1-Methylpiperidin-4-yl)ethyl diphenylacetate--hydrogen chloride (1/1)
- IUPAC
- 2-(1-methylpiperidin-1-ium-4-yl)ethyl 2,2-diphenylacetate chloride
Names & synonyms
66902-45-2DTXSID809855232-(1-Methylpiperidin-4-yl)ethyl diphenylacetate--hydrogen chloride (1/1)RefChem:1060667DTXCID601412715Diphenylacetic acid 2-(1-methyl-4-piperidyl)ethyl ester hydrochlorideACETIC ACID, DIPHENYL-, 2-(1-METHYL-4-PIPERIDYL)ETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
66902-45-2- PubChem CID
- 48249
Properties
Computed structural properties
- Topological polar surface area
- 30.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 373
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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