2,3,6-tris(chloranyl)-4-(2,2-dimethylpentan-3-ylsulfanyl)phenol

Systemtic Name: 2,3,6-tris(chloranyl)-4-(2,2-dimethylpentan-3-ylsulfanyl)phenol Openeye Name: 2,3,6-trichloro-4-(1-ethyl-2,2-dimethyl-propyl)sulfanyl-phenol CAS Name: 2,3,6-trichloro-4-(2,2-dimethylpentan-3-ylthio)phenol IUPAC Name: 2,3,6-trichloro-4-(2,2-dimethylpentan-3-ylsulfanyl)phenol Traditional Name: 2,3,6-trichloro-4-[(1-ethyl-2,2-dimethyl-propyl)thio]phenol Formula: C13H17Cl3OS MolecularWeight: 327.69748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C)(C)C)SC1=CC(=C(C(=C1Cl)Cl)O)Cl

Isomeric SMILES

CCC(C(C)(C)C)SC1=CC(=C(C(=C1Cl)Cl)O)Cl

InChI

InChI=1S/C13H17Cl3OS/c1-5-9(13(2,3)4)18-8-6-7(14)12(17)11(16)10(8)15/h6,9,17H,5H2,1-4H3