[(2S)-2-[(2R,3S,6R)-6-methoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]propyl] 4-methylbenzenesulfonate

Systemtic Name: [(2S)-2-[(2R,3S,6R)-6-methoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]propyl] 4-methylbenzenesulfonate Openeye Name: [(2S)-2-[(2R,3S,6R)-6-methoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]propyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(2S)-2-[(2R,3S,6R)-6-methoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]propyl] ester IUPAC Name: [(2S)-2-[(2R,3S,6R)-6-methoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]propyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(2S)-2-[(2R,3S,6R)-6-methoxy-3-methyl-3,6-dihydro-2H-pyran-2-yl]propyl] ester Formula: C17H24O5S MolecularWeight: 340.43446

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Descriptors Computed from Structure

Canonical SMILES:

CC1C=CC(OC1C(C)COS(=O)(=O)C2=CC=C(C=C2)C)OC

Isomeric SMILES

C[C@H]1C=C[C@@H](O[C@H]1[C@@H](C)COS(=O)(=O)C2=CC=C(C=C2)C)OC

InChI

InChI=1S/C17H24O5S/c1-12-5-8-15(9-6-12)23(18,19)21-11-14(3)17-13(2)7-10-16(20-4)22-17/h5-10,13-14,16-17H,11H2,1-4H3/t13-,14-,16+,17+/m0/s1