Basic information
- CAS
55792-14-8- Standard SMILES
CCCCOc1cccc(NC(=O)OCC[NH+]2CCCCC2)c1.[Cl-]- InChIKey
UVUJBVNWETZJHV-UHFFFAOYSA-N- Molecular formula
- C18H29ClN2O3
- Average molar mass
- 356.9 g/mol
- Monoisotopic mass
- 356.1866705
Names & identifiers
- Preferred name
- 2-(Piperidin-1-yl)ethyl hydrogen (3-butoxyphenyl)carbonimidate--hydrogen chloride (1/1)
- IUPAC
- 2-piperidin-1-ium-1-ylethyl N-(3-butoxyphenyl)carbamate chloride
Names & synonyms
55792-14-8DTXSID009711802-(Piperidin-1-yl)ethyl hydrogen (3-butoxyphenyl)carbonimidate--hydrogen chloride (1/1)RefChem:1062013DTXCID201398696(3-Butoxyphenyl)carbamic acid 2-(1-piperidinyl)ethyl ester hydrochlorideCarbamic acid, (3-butoxyphenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochloride
Database identifiers
- CAS
55792-14-8- PubChem CID
- 41596
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 332
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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