Basic information
- CAS
3268-03-9- Standard SMILES
COc1ccc(CC(=O)OC2C[C@H]3CC[C@@H](C2)N3C)cc1.Cl- InChIKey
RYWKJMUVFVQHCM-DNCNHEBUSA-N- Molecular formula
- C17H24ClNO3
- Average molar mass
- 325.8 g/mol
- Monoisotopic mass
- 325.1444713
Names & identifiers
- Preferred name
- 3-psi-Tropine p-methoxyphenylacetate hydrochloride
- IUPAC
- [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 2-(4-methoxyphenyl)acetate;hydrochloride
Names & synonyms
3-psi-Tropine p-methoxyphenylacetate hydrochloride1-alpha-H,5-alpha-H-Tropan-3-beta-ol, p-methoxyphenylacetate, hydrochloride3268-03-9
Database identifiers
- CAS
3268-03-9- PubChem CID
- 201108
Properties
Computed structural properties
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 351
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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