Identification
Name |
Beclobrate |
Synonyms |
Ethyl 2-[4-[(4-Chlorophenyl)Methyl]Phenoxy]-2-Methyl-Butanoate; 2-[4-[(4-Chlorophenyl)Methyl]Phenoxy]-2-Methylbutanoic Acid Ethyl Ester; 2-[4-(4-Chlorobenzyl)Phenoxy]-2-Methyl-Butyric Acid Ethyl Ester |
|
Molecular Structure |
 |
Molecular Formula |
C20H23ClO3 |
Molecular Weight |
346.85 |
CAS Registry Number |
55937-99-0 (57081-61-5) |
EINECS |
259-912-4 |
SMILES |
C1=C(OC(C(OCC)=O)(CC)C)C=CC(=C1)CC2=CC=C(C=C2)Cl |
InChI |
1S/C20H23ClO3/c1-4-20(3,19(22)23-5-2)24-18-12-8-16(9-13-18)14-15-6-10-17(21)11-7-15/h6-13H,4-5,14H2,1-3H3 |
InChIKey |
YWQGBCXVCXMSLJ-UHFFFAOYSA-N |
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