Basic information
- Standard SMILES
COc1ccc(CC(=O)NC2CC3(CCC3)Oc3ccc(Cl)cc32)cc1OC- InChIKey
JUUASZJSABQVJZ-UHFFFAOYSA-N- Molecular formula
- C22H24ClNO4
- Average molar mass
- 401.9 g/mol
- Monoisotopic mass
- 401.1393859
Names & identifiers
- Preferred name
- N-(6-Chloro-3,4-dihydrospiro[chromene-2,1'-cyclobutan]-4-yl)-2-(3,4-dimethoxyphenyl)acetamide
- IUPAC
- N-(6-chlorospiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-yl)-2-(3,4-dimethoxyphenyl)acetamide
Names & synonyms
SCHEMBL3431268JUUASZJSABQVJZ-UHFFFAOYSA-NN-(6-Chloro-3,4-dihydrospiro[chromene-2,1'-cyclobutan]-4-yl)-2-(3,4-dimethoxyphenyl)acetamide
Database identifiers
- PubChem CID
- 44132276
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 555
Related reactions
1 records
Compound notes
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