Carbamic acid, (3-(nonyloxy)phenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochloride
Basic information
- CAS
55792-27-3- Standard SMILES
CCCCCCCCCOc1cccc(NC(=O)OCC[NH+]2CCCCC2)c1.[Cl-]- InChIKey
SHTNQKQTHGWMQU-UHFFFAOYSA-N- Molecular formula
- C23H39ClN2O3
- Average molar mass
- 427 g/mol
- Monoisotopic mass
- 426.2649208
Names & identifiers
- Preferred name
- Carbamic acid, (3-(nonyloxy)phenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochloride
- IUPAC
- 2-piperidin-1-ium-1-ylethyl N-(3-nonoxyphenyl)carbamate chloride
Names & synonyms
(3-(Nonyloxy)phenyl)carbamic acid 2-(1-piperidinyl)ethyl ester hydrochlorideCarbamic acid, (3-(nonyloxy)phenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochloride55792-27-3RefChem:332017
Database identifiers
- CAS
55792-27-3- PubChem CID
- 41622
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 399
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Compound notes
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