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

Systemtic Name: [(3S)-5-methyl-1-(4-methylphenyl)sulfonyl-2-oxidanylidene-hexan-3-yl] ethanoate Openeye Name: [(1S)-3-methyl-1-[2-(p-tolylsulfonyl)acetyl]butyl] acetate CAS Name: acetic acid [(3S)-5-methyl-1-(4-methylphenyl)sulfonyl-2-oxohexan-3-yl] ester IUPAC Name: [(3S)-5-methyl-1-(4-methylphenyl)sulfonyl-2-oxohexan-3-yl] acetate Traditional Name: acetic acid [(1S)-3-methyl-1-(2-tosylacetyl)butyl] ester Formula: C16H22O5S MolecularWeight: 326.40788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O5S/c1-11(2)9-16(21-13(4)17)15(18)10-22(19,20)14-7-5-12(3)6-8-14/h5-8,11,16H,9-10H2,1-4H3/t16-/m0/s1