4-[4-[3,4-bis(chloranyl)phenoxy]phenyl]-2-ethanoylsulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-[3,4-bis(chloranyl)phenoxy]phenyl]-2-ethanoylsulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 2-acetylsulfanyl-4-[4-(3,4-dichlorophenoxy)phenyl]-4-oxo-butanoic acid CAS Name: 2-(acetylthio)-4-[4-(3,4-dichlorophenoxy)phenyl]-4-oxobutanoic acid IUPAC Name: 2-acetylsulfanyl-4-[4-(3,4-dichlorophenoxy)phenyl]-4-oxobutanoic acid Traditional Name: 2-(acetylthio)-4-[4-(3,4-dichlorophenoxy)phenyl]-4-keto-butyric acid Formula: C18H14Cl2O5S MolecularWeight: 413.27176

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)C1=CC=C(C=C1)OC2=CC(=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

CC(=O)SC(CC(=O)C1=CC=C(C=C1)OC2=CC(=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C18H14Cl2O5S/c1-10(21)26-17(18(23)24)9-16(22)11-2-4-12(5-3-11)25-13-6-7-14(19)15(20)8-13/h2-8,17H,9H2,1H3,(H,23,24)