Basic information
- CAS
105405-71-8- Standard SMILES
CCCCCOc1cccc(NC(=O)OC2CC[NH+](CC)CC2)c1.[Cl-]- InChIKey
CEHIXBFHHBHOGB-UHFFFAOYSA-N- Molecular formula
- C19H31ClN2O3
- Average molar mass
- 370.9 g/mol
- Monoisotopic mass
- 370.2023205
Names & identifiers
- Preferred name
- Carbanilic acid, m-(pentyloxy)-, 1-ethyl-4-piperidyl ester, hydrochloride
- IUPAC
- (1-ethylpiperidin-1-ium-4-yl) N-(3-pentoxyphenyl)carbamate chloride
Names & synonyms
PAK 4235105405-71-8Carbamic acid, (3-(pentyloxy)phenyl)-, 1-ethyl-4-piperidinyl ester, monohydrochloridem-(Pentyloxy)carbanilic acid 1-ethyl-4-piperidyl ester hydrochlorideCARBANILIC ACID, m-(PENTYLOXY)-, 1-ETHYL-4-PIPERIDYL ESTER, HYDROCHLORIDERefChem:333022(1-ethylpiperidin-1-ium-4-yl) N-(3-pentoxyphenyl)carbamate;chloride
Database identifiers
- CAS
105405-71-8- PubChem CID
- 60005
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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