4-[3,5-bis(chloranyl)-4-methyl-phenyl]-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[3,5-bis(chloranyl)-4-methyl-phenyl]-2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,5-dichloro-4-methyl-phenyl)-2-(2-ethoxy-2-oxo-ethyl)sulfanyl-4-oxo-butanoic acid CAS Name: 4-(3,5-dichloro-4-methylphenyl)-2-[(2-ethoxy-2-oxoethyl)thio]-4-oxobutanoic acid IUPAC Name: 4-(3,5-dichloro-4-methylphenyl)-2-(2-ethoxy-2-oxoethyl)sulfanyl-4-oxobutanoic acid Traditional Name: 4-(3,5-dichloro-4-methyl-phenyl)-2-[(2-ethoxy-2-keto-ethyl)thio]-4-keto-butyric acid Formula: C15H16Cl2O5S MolecularWeight: 379.25554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16Cl2O5S/c1-3-22-14(19)7-23-13(15(20)21)6-12(18)9-4-10(16)8(2)11(17)5-9/h4-5,13H,3,6-7H2,1-2H3,(H,20,21)