6-[3,6,7,8-tetrakis(chloranyl)phenoxathiin-2-yl]oxyhexanoic acid

Systemtic Name: 6-[3,6,7,8-tetrakis(chloranyl)phenoxathiin-2-yl]oxyhexanoic acid Openeye Name: 6-(3,6,7,8-tetrachlorophenoxathiin-2-yl)oxyhexanoic acid CAS Name: 6-[(3,6,7,8-tetrachloro-2-phenoxathiinyl)oxy]hexanoic acid IUPAC Name: 6-(3,6,7,8-tetrachlorophenoxathiin-2-yl)oxyhexanoic acid Traditional Name: 6-(3,6,7,8-tetrachlorophenoxathiin-2-yl)oxyhexanoic acid Formula: C18H14Cl4O4S MolecularWeight: 468.17836

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1Cl)OCCCCCC(=O)O)SC3=CC(=C(C(=C3O2)Cl)Cl)Cl

Isomeric SMILES

C1=C2C(=CC(=C1Cl)OCCCCCC(=O)O)SC3=CC(=C(C(=C3O2)Cl)Cl)Cl

InChI

InChI=1S/C18H14Cl4O4S/c19-9-6-12-13(8-11(9)25-5-3-1-2-4-15(23)24)27-14-7-10(20)16(21)17(22)18(14)26-12/h6-8H,1-5H2,(H,23,24)