(3-(Octyloxy)phenyl)carbamic acid 2-(1-piperidinyl)ethyl ester hydrochloride
Basic information
- CAS
55792-25-1- Standard SMILES
CCCCCCCCOc1cccc(NC(=O)OCC[NH+]2CCCCC2)c1.[Cl-]- InChIKey
POYVBLZDHNJRJS-UHFFFAOYSA-N- Molecular formula
- C22H37ClN2O3
- Average molar mass
- 413 g/mol
- Monoisotopic mass
- 412.2492707
Names & identifiers
- Preferred name
- (3-(Octyloxy)phenyl)carbamic acid 2-(1-piperidinyl)ethyl ester hydrochloride
- IUPAC
- 2-piperidin-1-ium-1-ylethyl N-(3-octoxyphenyl)carbamate chloride
Names & synonyms
Carbamic acid, (3-(octyloxy)phenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochloride(3-(Octyloxy)phenyl)carbamic acid 2-(1-piperidinyl)ethyl ester hydrochloride
Database identifiers
- CAS
55792-25-1- PubChem CID
- 41618
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 386
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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