Basic information
- CAS
105405-73-0- Standard SMILES
CCCCCCOc1cccc(NC(=O)OC2CC[NH+](CC)CC2)c1.[Cl-]- InChIKey
HEXGBFQHVBQVGT-UHFFFAOYSA-N- Molecular formula
- C20H33ClN2O3
- Average molar mass
- 384.9 g/mol
- Monoisotopic mass
- 384.2179706
Names & identifiers
- Preferred name
- Carbanilic acid, m-(hexyloxy)-, 1-ethyl-4-piperidyl ester, hydrochloride
- IUPAC
- (1-ethylpiperidin-1-ium-4-yl) N-(3-hexoxyphenyl)carbamate chloride
Names & synonyms
PAK 4236105405-73-0Carbamic acid, (3-(hexyloxy)phenyl)-, 1-ethyl-4-piperidinyl ester, monohydrochloridem-(Hexyloxy)carbanilic acid 1-ethyl-4-piperidyl ester hydrochlorideCARBANILIC ACID, m-(HEXYLOXY)-, 1-ETHYL-4-PIPERIDYL ESTER, HYDROCHLORIDERefChem:333020(1-ethylpiperidin-1-ium-4-yl) N-(3-hexoxyphenyl)carbamate;chloride
Database identifiers
- CAS
105405-73-0- PubChem CID
- 60009
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 370
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…