Carbanilic acid, o-((pentyloxy)methyl)-, 2-piperidinoethyl ester, hydrochloride
Basic information
- CAS
80171-73-9- Standard SMILES
CCCCCOCc1ccccc1NC(=O)OCC[NH+]1CCCCC1.[Cl-]- InChIKey
BBUHWEXSILPYSC-UHFFFAOYSA-N- Molecular formula
- C20H33ClN2O3
- Average molar mass
- 384.9 g/mol
- Monoisotopic mass
- 384.2179706
Names & identifiers
- Preferred name
- Carbanilic acid, o-((pentyloxy)methyl)-, 2-piperidinoethyl ester, hydrochloride
- IUPAC
- 2-piperidin-1-ium-1-ylethyl N-[2-(pentoxymethyl)phenyl]carbamate chloride
Names & synonyms
AMK 254o-((Pentyloxy)methyl)carbanilic acid 2-piperidinoethyl ester hydrochlorideCARBANILIC ACID, o-((PENTYLOXY)METHYL)-, 2-PIPERIDINOETHYL ESTER, HYDROCHLORIDE80171-73-9RefChem:333082
Database identifiers
- CAS
80171-73-9- PubChem CID
- 54507
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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