Basic information
- CAS
29848-21-3- Standard SMILES
Cc1cc(C)c(NC(=O)OC2CCCCC2[NH+]2CCCC2)c(C)c1.[Cl-]- InChIKey
HKOUJCDVIVCVBO-UHFFFAOYSA-N- Molecular formula
- C20H31ClN2O2
- Average molar mass
- 366.9 g/mol
- Monoisotopic mass
- 366.2074059
Names & identifiers
- Preferred name
- 2-(Pyrrolidin-1-yl)cyclohexyl hydrogen (2,4,6-trimethylphenyl)carbonimidate--hydrogen chloride (1/1)
- IUPAC
- (2-pyrrolidin-1-ium-1-ylcyclohexyl) N-(2,4,6-trimethylphenyl)carbamate chloride
Names & synonyms
29848-21-3DTXSID309523012-(Pyrrolidin-1-yl)cyclohexyl hydrogen (2,4,6-trimethylphenyl)carbonimidate--hydrogen chloride (1/1)RefChem:1062047DTXCID3013803992,4,6-Trimethylcarbanilic acid 2-(1-pyrrolidinyl)cyclohexyl ester hydrochlorideK 1602Carbanilic acid, 2,4,6-trimethyl-, 2-(1-pyrrolidinyl)cyclohexyl ester, hydrochloride
Database identifiers
- CAS
29848-21-3- PubChem CID
- 34736
Properties
Computed structural properties
- Topological polar surface area
- 42.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 410
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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