(2S,3R)-2-methyl-3-(4-methylphenyl)sulfonyloxy-6-phenylmethoxy-hexanoic acid

Systemtic Name: (2S,3R)-2-methyl-3-(4-methylphenyl)sulfonyloxy-6-phenylmethoxy-hexanoic acid Openeye Name: (2S,3R)-6-benzyloxy-2-methyl-3-(p-tolylsulfonyloxy)hexanoic acid CAS Name: (2S,3R)-2-methyl-3-(4-methylphenyl)sulfonyloxy-6-phenylmethoxyhexanoic acid IUPAC Name: (2S,3R)-2-methyl-3-(4-methylphenyl)sulfonyloxy-6-phenylmethoxyhexanoic acid Traditional Name: (2S,3R)-6-benzoxy-2-methyl-3-tosyloxy-hexanoic acid Formula: C21H26O6S MolecularWeight: 406.49254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(CCCOCC2=CC=CC=C2)C(C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[C@H](CCCOCC2=CC=CC=C2)[C@H](C)C(=O)O

InChI

InChI=1S/C21H26O6S/c1-16-10-12-19(13-11-16)28(24,25)27-20(17(2)21(22)23)9-6-14-26-15-18-7-4-3-5-8-18/h3-5,7-8,10-13,17,20H,6,9,14-15H2,1-2H3,(H,22,23)/t17-,20+/m0/s1