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

Systemtic Name: 2,3,6-tris(chloranyl)-4-(3,3-dimethylpentan-2-ylsulfanyl)phenol Openeye Name: 2,3,6-trichloro-4-(1,2,2-trimethylbutylsulfanyl)phenol CAS Name: 2,3,6-trichloro-4-(3,3-dimethylpentan-2-ylthio)phenol IUPAC Name: 2,3,6-trichloro-4-(3,3-dimethylpentan-2-ylsulfanyl)phenol Traditional Name: 2,3,6-trichloro-4-(1,2,2-trimethylbutylthio)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/c1-5-13(3,4)7(2)18-9-6-8(14)12(17)11(16)10(9)15/h6-7,17H,5H2,1-4H3