ethyl (3S,4R)-5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-2-oxidanylidene-oxolane-3-carboxylate

Systemtic Name: ethyl (3S,4R)-5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-2-oxidanylidene-oxolane-3-carboxylate Openeye Name: ethyl (3S,4R)-5,5-dimethyl-2-oxo-4-(p-tolylsulfonylmethyl)tetrahydrofuran-3-carboxylate CAS Name: (3S,4R)-5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-2-oxo-3-oxolanecarboxylic acid ethyl ester IUPAC Name: ethyl (3S,4R)-5,5-dimethyl-4-[(4-methylphenyl)sulfonylmethyl]-2-oxooxolane-3-carboxylate Traditional Name: (3S,4R)-2-keto-5,5-dimethyl-4-(tosylmethyl)tetrahydrofuran-3-carboxylic acid ethyl ester Formula: C17H22O6S MolecularWeight: 354.41798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(OC1=O)(C)C)CS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](C(OC1=O)(C)C)CS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H22O6S/c1-5-22-15(18)14-13(17(3,4)23-16(14)19)10-24(20,21)12-8-6-11(2)7-9-12/h6-9,13-14H,5,10H2,1-4H3/t13-,14+/m1/s1