ethyl 2,2-dimethyl-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 2,2-dimethyl-4-(4-methylsulfanylphenyl)-4-oxidanylidene-butanoate Openeye Name: ethyl 2,2-dimethyl-4-(4-methylsulfanylphenyl)-4-oxo-butanoate CAS Name: 2,2-dimethyl-4-[4-(methylthio)phenyl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2,2-dimethyl-4-(4-methylsulfanylphenyl)-4-oxobutanoate Traditional Name: 4-keto-2,2-dimethyl-4-[4-(methylthio)phenyl]butyric acid ethyl ester Formula: C15H20O3S MolecularWeight: 280.3825

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)(C)CC(=O)C1=CC=C(C=C1)SC

Isomeric SMILES

CCOC(=O)C(C)(C)CC(=O)C1=CC=C(C=C1)SC

InChI

InChI=1S/C15H20O3S/c1-5-18-14(17)15(2,3)10-13(16)11-6-8-12(19-4)9-7-11/h6-9H,5,10H2,1-4H3