2-[5-[2,4-bis(chloranyl)phenoxy]-2-iodanyl-phenyl]ethanethioic S-acid

Systemtic Name: 2-[5-[2,4-bis(chloranyl)phenoxy]-2-iodanyl-phenyl]ethanethioic S-acid Openeye Name: 2-[5-(2,4-dichlorophenoxy)-2-iodo-phenyl]ethanethioic S-acid CAS Name: 2-[5-(2,4-dichlorophenoxy)-2-iodophenyl]ethanethioic S-acid IUPAC Name: 2-[5-(2,4-dichlorophenoxy)-2-iodophenyl]ethanethioic S-acid Traditional Name: 2-[5-(2,4-dichlorophenoxy)-2-iodo-phenyl]thioacetic acid Formula: C14H9Cl2IO2S MolecularWeight: 439.09553

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1OC2=C(C=C(C=C2)Cl)Cl)CC(=O)S)I

Isomeric SMILES

C1=CC(=C(C=C1OC2=C(C=C(C=C2)Cl)Cl)CC(=O)S)I

InChI

InChI=1S/C14H9Cl2IO2S/c15-9-1-4-13(11(16)7-9)19-10-2-3-12(17)8(5-10)6-14(18)20/h1-5,7H,6H2,(H,18,20)