Cinnamic acid, alpha-(o-methoxyphenyl)-, 3-tropanyl ester, hydrochloride
Basic information
- CAS
67210-58-6- Standard SMILES
COc1ccccc1/C(=C\c1ccccc1)C(=O)OC1CC2CCC(C1)[NH+]2C.[Cl-]- InChIKey
SOKALSGXBZQIDG-CWUUNJJBSA-N- Molecular formula
- C24H28ClNO3
- Average molar mass
- 413.9 g/mol
- Monoisotopic mass
- 413.1757714
Names & identifiers
- Preferred name
- Cinnamic acid, alpha-(o-methoxyphenyl)-, 3-tropanyl ester, hydrochloride
- IUPAC
- (8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl) (E)-2-(2-methoxyphenyl)-3-phenylprop-2-enoate chloride
Names & synonyms
CINNAMIC ACID, alpha-(o-METHOXYPHENYL)-, 3-TROPANYL ESTER, HYDROCHLORIDE67210-58-6RefChem:1081781alpha-(o-Methoxyphenyl)cinnamic acid 3-tropanyl ester hydrochloride
Database identifiers
- CAS
67210-58-6- PubChem CID
- 6435010
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 554
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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