7-Methoxy-3-(3-methoxymethoxy-pyridin-4-yl)-1,1-dimethyl-3,4-dihydro-1H-naphthalen-2-one
Basic information
- Standard SMILES
COCOc1cnccc1C1Cc2ccc(OC)cc2C(C)(C)C1=O- InChIKey
KZSXMOCMURMFFW-UHFFFAOYSA-N- Molecular formula
- C20H23NO4
- Average molar mass
- 341.4 g/mol
- Monoisotopic mass
- 341.16270821
Names & identifiers
- Preferred name
- 7-Methoxy-3-(3-methoxymethoxy-pyridin-4-yl)-1,1-dimethyl-3,4-dihydro-1H-naphthalen-2-one
- IUPAC
- 7-methoxy-3-[3-(methoxymethoxy)-4-pyridinyl]-1,1-dimethyl-3,4-dihydronaphthalen-2-one
Names & synonyms
SCHEMBL898507KZSXMOCMURMFFW-UHFFFAOYSA-N7-Methoxy-3-(3-methoxymethoxy-pyridin-4-yl)-1,1-dimethyl-3,4-dihydro-1H-naphthalen-2-one
Database identifiers
- PubChem CID
- 66835166
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 57.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 467
Related reactions
4 records
Compound notes
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