Basic information
- Standard SMILES
COC(=O)COc1ccc(OC/C=C(\c2ccc(I)cc2)c2ccc(SC)cc2)cc1C- InChIKey
JCGFMZWBPOXRAV-ZVHZXABRSA-N- Molecular formula
- C26H25IO4S
- Average molar mass
- 560.4 g/mol
Names & identifiers
- Preferred name
- methyl (Z)-[4-[3-(4-iodophenyl)-3-(4-methylsulfanylphenyl)allyloxy]-2-methylphenoxy]acetate
- IUPAC
- methyl 2-[4-[(Z)-3-(4-iodophenyl)-3-(4-methylsulfanylphenyl)prop-2-enoxy]-2-methylphenoxy]acetate
Names & synonyms
JCGFMZWBPOXRAV-ZVHZXABRSA-Nmethyl (z)-[4-[3-(4-iodophenyl)-3-(4-methylsulfanyl-phenyl)allyloxy]-2-methylphenoxy]acetatemethyl (Z)-[4-[3-(4-iodophenyl)-3-(4-methylsulfanylphenyl)allyloxy]-2-methylphenoxy]acetatemethyl (Z)-[4-[3-(4-iodophenyl)-3-[4-(methylsulfanyl)-phenyl]allyloxy]-2-methylphenoxy]acetatemethyl (Z)-[4-[3-(4-iodophenyl)-3-[4-(methylsulfanyl)phenyl]allyloxy]-2-methylphenoxy]acetate
Database identifiers
- PubChem CID
- 86629314
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 597
Related reactions
9 records
Compound notes
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