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methyl 2,3,4-tris(chloranyl)-5-oxidanyl-6-pentyl-benzoate

methyl 2,3,4-tris(chloranyl)-5-oxidanyl-6-pentyl-benzoate

Systemtic Name:methyl 2,3,4-tris(chloranyl)-5-oxidanyl-6-pentyl-benzoate
Openeye Name:methyl 2,3,4-trichloro-5-hydroxy-6-pentyl-benzoate
CAS Name:2,3,4-trichloro-5-hydroxy-6-pentylbenzoic acid methyl ester
IUPAC Name:methyl 2,3,4-trichloro-5-hydroxy-6-pentylbenzoate
Traditional Name:2-amyl-4,5,6-trichloro-3-hydroxy-benzoic acid methyl ester
Formula: C13H15Cl3O3
MolecularWeight: 325.6154
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(C(=C1O)Cl)Cl)Cl)C(=O)OC


Isomeric SMILES

CCCCCC1=C(C(=C(C(=C1O)Cl)Cl)Cl)C(=O)OC


InChI

InChI=1S/C13H15Cl3O3/c1-3-4-5-6-7-8(13(18)19-2)9(14)10(15)11(16)12(7)17/h17H,3-6H2,1-2H3


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