Basic information
- CAS
31755-26-7- Standard SMILES
CCCC[NH+]1CCCC(OC(=O)Nc2c(C)cccc2C)C1.[Cl-]- InChIKey
MWSQXWNRFAPKRH-UHFFFAOYSA-N- Molecular formula
- C18H29ClN2O2
- Average molar mass
- 340.9 g/mol
- Monoisotopic mass
- 340.1917559
Names & identifiers
- Preferred name
- Carbanilic acid, 2,6-dimethyl-, N-butyl-3-piperidinyl ester, hydrochloride
- IUPAC
- (1-butylpiperidin-1-ium-3-yl) N-(2,6-dimethylphenyl)carbamate chloride
Names & synonyms
31755-26-7CARBANILIC ACID, 2,6-DIMETHYL-, N-BUTYL-3-PIPERIDINYL ESTER, HYDROCHLORIDERefChem:1081051N-Butyl-3-piperidyl 2,6-dimethylphenylcarbamate hydrochlorideN-Butyl-3-piperidinyl 2,6-dimethylcarbanilate hydrochloride2,6-Dimethylcarbanilic acid hydrochloride, N-butyl-3-piperidinyl ester
Database identifiers
- CAS
31755-26-7- PubChem CID
- 35910
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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