pentyl 2,3,5-tris(chloranyl)-6-oxidanyl-benzoate

Systemtic Name: pentyl 2,3,5-tris(chloranyl)-6-oxidanyl-benzoate Openeye Name: pentyl 2,3,5-trichloro-6-hydroxy-benzoate CAS Name: 2,3,5-trichloro-6-hydroxybenzoic acid pentyl ester IUPAC Name: pentyl 2,3,5-trichloro-6-hydroxybenzoate Traditional Name: 2,3,5-trichloro-6-hydroxy-benzoic acid amyl ester Formula: C12H13Cl3O3 MolecularWeight: 311.58882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(C(=CC(=C1Cl)Cl)Cl)O

Isomeric SMILES

CCCCCOC(=O)C1=C(C(=CC(=C1Cl)Cl)Cl)O

InChI

InChI=1S/C12H13Cl3O3/c1-2-3-4-5-18-12(17)9-10(15)7(13)6-8(14)11(9)16/h6,16H,2-5H2,1H3