Basic information
- Standard SMILES
COc1ccc(Cl)cc1C1(OC)CCN(C(=O)OC(C)(C)C)CC1- InChIKey
ZHFPRMNLHONHBO-UHFFFAOYSA-N- Molecular formula
- C18H26ClNO4
- Average molar mass
- 355.9 g/mol
Names & identifiers
- Preferred name
- 4-(5-Chloro-2-methoxy-phenyl)-4-methoxy-piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl 4-(5-chloro-2-methoxyphenyl)-4-methoxypiperidine-1-carboxylate
Names & synonyms
SCHEMBL12897762ZHFPRMNLHONHBO-UHFFFAOYSA-N4-(5-chloro-2-methoxy-phenyl)-4-methoxy-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 58772528
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 429
Related reactions
3 records
Compound notes
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