butyl 2-(4-chloranyl-2-methyl-phenoxy)ethanoate; pentyl 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate

Systemtic Name: butyl 2-(4-chloranyl-2-methyl-phenoxy)ethanoate; pentyl 2-[2,4,5-tris(chloranyl)phenoxy]ethanoate Openeye Name: butyl 2-(4-chloro-2-methyl-phenoxy)acetate; pentyl 2-(2,4,5-trichlorophenoxy)acetate CAS Name: 2-(4-chloro-2-methylphenoxy)acetic acid butyl ester; 2-(2,4,5-trichlorophenoxy)acetic acid pentyl ester IUPAC Name: butyl 2-(4-chloro-2-methylphenoxy)acetate; pentyl 2-(2,4,5-trichlorophenoxy)acetate Traditional Name: 2-(4-chloro-2-methyl-phenoxy)acetic acid butyl ester; 2-(2,4,5-trichlorophenoxy)acetic acid amyl ester Formula: C26H32Cl4O6 MolecularWeight: 582.34068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl.CCCCOC(=O)COC1=C(C=C(C=C1)Cl)C

Isomeric SMILES

CCCCCOC(=O)COC1=CC(=C(C=C1Cl)Cl)Cl.CCCCOC(=O)COC1=C(C=C(C=C1)Cl)C

InChI

InChI=1S/C13H15Cl3O3.C13H17ClO3/c1-2-3-4-5-18-13(17)8-19-12-7-10(15)9(14)6-11(12)16;1-3-4-7-16-13(15)9-17-12-6-5-11(14)8-10(12)2/h6-7H,2-5,8H2,1H3;5-6,8H,3-4,7,9H2,1-2H3