[(2R,3R,5S)-5-acetyloxy-3-(4-methylphenyl)sulfonyloxy-thiolan-2-yl]methyl ethanoate

Systemtic Name: [(2R,3R,5S)-5-acetyloxy-3-(4-methylphenyl)sulfonyloxy-thiolan-2-yl]methyl ethanoate Openeye Name: [(2R,3R,5S)-5-acetoxy-3-(p-tolylsulfonyloxy)tetrahydrothiophen-2-yl]methyl acetate CAS Name: acetic acid [(2R,3R,5S)-5-acetyloxy-3-(4-methylphenyl)sulfonyloxy-2-thiolanyl]methyl ester IUPAC Name: [(2R,3R,5S)-5-acetyloxy-3-(4-methylphenyl)sulfonyloxythiolan-2-yl]methyl acetate Traditional Name: acetic acid [(2R,3R,5S)-5-acetoxy-3-tosyloxy-tetrahydrothiophen-2-yl]methyl ester Formula: C16H20O7S2 MolecularWeight: 388.4558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2CC(SC2COC(=O)C)OC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@@H]2C[C@H](S[C@@H]2COC(=O)C)OC(=O)C

InChI

InChI=1S/C16H20O7S2/c1-10-4-6-13(7-5-10)25(19,20)23-14-8-16(22-12(3)18)24-15(14)9-21-11(2)17/h4-7,14-16H,8-9H2,1-3H3/t14-,15-,16+/m1/s1