ethyl 4-[(4-methylphenyl)sulfonyl-methylsulfanyl-methyl]-2-oxidanylidene-oxolane-3-carboxylate

Systemtic Name: ethyl 4-[(4-methylphenyl)sulfonyl-methylsulfanyl-methyl]-2-oxidanylidene-oxolane-3-carboxylate Openeye Name: ethyl 4-[methylsulfanyl(p-tolylsulfonyl)methyl]-2-oxo-tetrahydrofuran-3-carboxylate CAS Name: 4-[(4-methylphenyl)sulfonyl-(methylthio)methyl]-2-oxo-3-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methylphenyl)sulfonyl-methylsulfanylmethyl]-2-oxooxolane-3-carboxylate Traditional Name: 2-keto-4-[(methylthio)-tosyl-methyl]tetrahydrofuran-3-carboxylic acid ethyl ester Formula: C16H20O6S2 MolecularWeight: 372.4564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(COC1=O)C(SC)S(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1C(COC1=O)C(SC)S(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H20O6S2/c1-4-21-14(17)13-12(9-22-15(13)18)16(23-3)24(19,20)11-7-5-10(2)6-8-11/h5-8,12-13,16H,4,9H2,1-3H3