Basic information
- CAS
38198-47-9- Standard SMILES
CCCOc1ccc(NC(=O)OC2CCCCC2[NH+]2CCCC2)cc1.[Cl-]- InChIKey
DHUSFPPGUOKASG-UHFFFAOYSA-N- Molecular formula
- C20H31ClN2O3
- Average molar mass
- 382.9 g/mol
- Monoisotopic mass
- 382.2023205
Names & identifiers
- Preferred name
- 2-(Pyrrolidin-1-yl)cyclohexyl (4-propoxyphenyl)carbamate--hydrogen chloride (1/1)
- IUPAC
- (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(4-propoxyphenyl)carbamate chloride
Names & synonyms
DTXSID909591392-(Pyrrolidin-1-yl)cyclohexyl (4-propoxyphenyl)carbamate--hydrogen chloride (1/1)RefChem:1062046DTXCID701387028p-Propoxycarbanilic acid trans-2-(1-pyrrolidinyl)cyclohexyl ester hydrochloride38198-47-9Carbanilic acid, p-propoxy-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride, (E)-
Database identifiers
- CAS
38198-47-9- PubChem CID
- 37962
Properties
Computed structural properties
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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