Basic information
- Standard SMILES
CC1(COc2ccc(Cl)cc2/C=C2\C(=O)N(C(=O)OC(C)(C)C)c3cc(Cl)ccc32)COC1- InChIKey
YUVUQTWLXMNVCK-GRSHGNNSSA-N- Molecular formula
- C25H25Cl2NO5
- Average molar mass
- 490.4 g/mol
Names & identifiers
- Preferred name
- Z-6-Chloro-3-[5-chloro-2-(3-methyl-oxetan-3-ylmethoxy)-benzylidene]-2-oxo-2,3-dihydro-indole-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl (3Z)-6-chloro-3-[[5-chloro-2-[(3-methyloxetan-3-yl)methoxy]phenyl]methylidene]-2-oxoindole-1-carboxylate
Names & synonyms
YUVUQTWLXMNVCK-GRSHGNNSSA-NZ-6-Chloro-3-[5-chloro-2-(3- methyl-oxetan-3-ylmethoxy)-benzylidene]-2-oxo-2,3-dihydro-indole-1-carboxylic acid tert-butyl esterZ-6-Chloro-3-[5-chloro-2-(3-methyl-oxetan-3-ylmethoxy)-benzylidene]-2-oxo-2,3-dihydro-indole-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 86632063
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 65.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 790
Related reactions
1 records
Compound notes
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