ethyl 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-3-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[3,5-bis(chloranyl)-4-oxidanyl-phenyl]sulfanyl-3-oxidanylidene-butanoate Openeye Name: ethyl 4-(3,5-dichloro-4-hydroxy-phenyl)sulfanyl-3-oxo-butanoate CAS Name: 4-[(3,5-dichloro-4-hydroxyphenyl)thio]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(3,5-dichloro-4-hydroxyphenyl)sulfanyl-3-oxobutanoate Traditional Name: 4-[(3,5-dichloro-4-hydroxy-phenyl)thio]-3-keto-butyric acid ethyl ester Formula: C12H12Cl2O4S MolecularWeight: 323.19228

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CSC1=CC(=C(C(=C1)Cl)O)Cl

Isomeric SMILES

CCOC(=O)CC(=O)CSC1=CC(=C(C(=C1)Cl)O)Cl

InChI

InChI=1S/C12H12Cl2O4S/c1-2-18-11(16)3-7(15)6-19-8-4-9(13)12(17)10(14)5-8/h4-5,17H,2-3,6H2,1H3