2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[2,6-bis(chloranyl)phenyl]methylsulfanyl]ethanoic acid Openeye Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]acetic acid CAS Name: 2-[(2,6-dichlorophenyl)methylthio]acetic acid IUPAC Name: 2-[(2,6-dichlorophenyl)methylsulfanyl]acetic acid Traditional Name: 2-[(2,6-dichlorobenzyl)thio]acetic acid Formula: C9H8Cl2O2S MolecularWeight: 251.12962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSCC(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSCC(=O)O)Cl

InChI

InChI=1S/C9H8Cl2O2S/c10-7-2-1-3-8(11)6(7)4-14-5-9(12)13/h1-3H,4-5H2,(H,12,13)