Basic information
- Standard SMILES
COc1ccc(COc2ccc(COc3ccc4c(c3)CCC(CN(C)C)C4)cc2)cc1- InChIKey
HDBARDRBAUDXBB-UHFFFAOYSA-N- Molecular formula
- C28H33NO3
- Average molar mass
- 431.6 g/mol
Names & identifiers
- Preferred name
- 2-[(N,N-Dimethylamino)methyl]-6-[4-[(4-methoxybenzyl)oxy]benzyloxy]tetralin
- IUPAC
- 1-[6-[[4-[(4-methoxyphenyl)methoxy]phenyl]methoxy]-1,2,3,4-tetrahydronaphthalen-2-yl]-N,N-dimethylmethanamine
Names & synonyms
SCHEMBL5582606HDBARDRBAUDXBB-UHFFFAOYSA-N2-[(N,N-Dimethylamino)methyl]-6-[4-[(4-methoxybenzyl)oxy]benzyloxy]tetralin
Database identifiers
- PubChem CID
- 21940053
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 30.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 525
Related reactions
2 records
Compound notes
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