Basic information
- Standard SMILES
Cl.O=C(CCCCN1CCC(C(O)(c2ccccc2)c2ccccc2)CC1)c1ccccc1- InChIKey
YJKDAPZCPMIMKY-UHFFFAOYSA-N- Molecular formula
- C29H34ClNO2
- Average molar mass
- 464 g/mol
- Monoisotopic mass
- 463.227807
Names & identifiers
- Preferred name
- 5-[4-(alpha-Hydroxy-alpha-phenylbenzyl)piperidino]valerophenone hydrochloride
- IUPAC
- 5-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]-1-phenylpentan-1-one;hydrochloride
Names & synonyms
SCHEMBL11863146YJKDAPZCPMIMKY-UHFFFAOYSA-N5-[4-(alpha-hydroxy-alpha-phenylbenzyl)piperidino]valerophenone hydrochloride
Database identifiers
- PubChem CID
- 21552998
Properties
Computed structural properties
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 532
Related reactions
1 records
Compound notes
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