Basic information
- CAS
52205-62-6- Standard SMILES
CCCCCOc1cccc(NC(=O)OCC[NH+]2CCCCC2)c1.[Cl-]- InChIKey
PVYQVMAMRKVLHM-UHFFFAOYSA-N- Molecular formula
- C19H31ClN2O3
- Average molar mass
- 370.9 g/mol
- Monoisotopic mass
- 370.2023205
Names & identifiers
- Preferred name
- Carbamic acid, (3-(pentyloxy)phenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochloride
- IUPAC
- 2-piperidin-1-ium-1-ylethyl N-(3-pentoxyphenyl)carbamate chloride
Names & synonyms
m-(Pentyloxy)carbanilic acid 2-piperidinoethyl ester monohydrochlorideCarbamic acid, (3-(pentyloxy)phenyl)-, 2-(1-piperidinyl)ethyl ester, monohydrochlorideCARBANILIC ACID, m-(PENTYLOXY)-, 2-PIPERIDINOETHYL ESTER, MONOHYDROCHLORIDE
Database identifiers
- CAS
52205-62-6- PubChem CID
- 40281
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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