[(2S,3S)-5-methyl-1-(4-methylphenyl)sulfonyl-2-oxidanyl-hexan-3-yl] ethanoate

Systemtic Name: [(2S,3S)-5-methyl-1-(4-methylphenyl)sulfonyl-2-oxidanyl-hexan-3-yl] ethanoate Openeye Name: [(1S)-1-[(1S)-1-hydroxy-2-(p-tolylsulfonyl)ethyl]-3-methyl-butyl] acetate CAS Name: acetic acid [(2S,3S)-2-hydroxy-5-methyl-1-(4-methylphenyl)sulfonylhexan-3-yl] ester IUPAC Name: [(2S,3S)-2-hydroxy-5-methyl-1-(4-methylphenyl)sulfonylhexan-3-yl] acetate Traditional Name: acetic acid [(1S)-1-[(1S)-1-hydroxy-2-tosyl-ethyl]-3-methyl-butyl] ester Formula: C16H24O5S MolecularWeight: 328.42376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O5S/c1-11(2)9-16(21-13(4)17)15(18)10-22(19,20)14-7-5-12(3)6-8-14/h5-8,11,15-16,18H,9-10H2,1-4H3/t15-,16+/m1/s1