ethyl 4-(2-chloranyl-4-methylsulfanyl-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(2-chloranyl-4-methylsulfanyl-phenyl)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(2-chloro-4-methylsulfanyl-phenyl)-4-oxo-butanoate CAS Name: 4-[2-chloro-4-(methylthio)phenyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(2-chloro-4-methylsulfanylphenyl)-4-oxobutanoate Traditional Name: 4-[2-chloro-4-(methylthio)phenyl]-4-keto-butyric acid ethyl ester Formula: C13H15ClO3S MolecularWeight: 286.7744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)C1=C(C=C(C=C1)SC)Cl

Isomeric SMILES

CCOC(=O)CCC(=O)C1=C(C=C(C=C1)SC)Cl

InChI

InChI=1S/C13H15ClO3S/c1-3-17-13(16)7-6-12(15)10-5-4-9(18-2)8-11(10)14/h4-5,8H,3,6-7H2,1-2H3