Basic information
- CAS
42438-16-4- Standard SMILES
CCCOc1ccc(NC(=O)OC(C)C[NH+]2CCCCC2)cc1.[Cl-]- InChIKey
FJMYSQODVKUMIB-UHFFFAOYSA-N- Molecular formula
- C18H29ClN2O3
- Average molar mass
- 356.9 g/mol
- Monoisotopic mass
- 356.1866705
Names & identifiers
- Preferred name
- Carbamic acid, (4-propoxyphenyl)-, 1-methyl-2-(1-piperidinyl)ethyl ester, monohydrochloride
- IUPAC
- 1-piperidin-1-ium-1-ylpropan-2-yl N-(4-propoxyphenyl)carbamate chloride
Names & synonyms
42438-16-4Carbamic acid, (4-propoxyphenyl)-, 1-methyl-2-(1-piperidinyl)ethyl ester, monohydrochlorideRefChem:1080839(4-Propoxyphenyl)carbamic acid 1-methyl-2-(1-piperidinyl)ethyl ester hydrochlorideCarbanilic acid, p-propoxy-, 1-methyl-2-piperidinoethyl ester, hydrochloride
Database identifiers
- CAS
42438-16-4- PubChem CID
- 39205
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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