Basic information
- Standard SMILES
CC(=O)OCCC1C=CC(C(=O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)=CC1(C)C- InChIKey
MYNDHQNDWZXPRX-UHFFFAOYSA-N- Molecular formula
- C34H43NO4
- Average molar mass
- 529.7 g/mol
Names & identifiers
- Preferred name
- 4-[4-[4-(Hydroxydiphenylmethyl)-1-piperidinyl]-1-oxobutyl]-2,2-dimethylphenethyl acetate
- IUPAC
- 2-[4-[4-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]butanoyl]-6,6-dimethylcyclohexa-2,4-dien-1-yl]ethyl acetate
Names & synonyms
SCHEMBL7620875MYNDHQNDWZXPRX-UHFFFAOYSA-N4-[4-[4-(hydroxydiphenylmethyl)-1-piperidinyl]-1-oxobutyl]-2,2-dimethylphenethyl acetate
Database identifiers
- PubChem CID
- 22906306
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 852
Related reactions
17 records
Compound notes
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