[(2S,3S,4S,6S)-2-(iodanylmethyl)-4,6-dimethoxy-oxan-3-yl] 4-methylbenzenesulfonate

Systemtic Name: [(2S,3S,4S,6S)-2-(iodanylmethyl)-4,6-dimethoxy-oxan-3-yl] 4-methylbenzenesulfonate Openeye Name: [(2S,3S,4S,6S)-2-(iodomethyl)-4,6-dimethoxy-tetrahydropyran-3-yl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S,3S,4S,6S)-2-(iodomethyl)-4,6-dimethoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4S,6S)-2-(iodomethyl)-4,6-dimethoxyoxan-3-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S,3S,4S,6S)-2-(iodomethyl)-4,6-dimethoxy-tetrahydropyran-3-yl] ester Formula: C15H21IO6S MolecularWeight: 456.29311

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2C(CC(OC2CI)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H21IO6S/c1-10-4-6-11(7-5-10)23(17,18)22-15-12(19-2)8-14(20-3)21-13(15)9-16/h4-7,12-15H,8-9H2,1-3H3/t12-,13+,14-,15-/m0/s1