[(2R,3S,4R,5R,6S)-4-methoxy-2-methyl-5-oxidanyl-6-prop-2-enoxy-oxan-3-yl] benzoate

Systemtic Name: [(2R,3S,4R,5R,6S)-4-methoxy-2-methyl-5-oxidanyl-6-prop-2-enoxy-oxan-3-yl] benzoate Openeye Name: [(2R,3S,4R,5R,6S)-6-allyloxy-5-hydroxy-4-methoxy-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2R,3S,4R,5R,6S)-5-hydroxy-4-methoxy-2-methyl-6-prop-2-enoxy-3-oxanyl] ester IUPAC Name: [(2R,3S,4R,5R,6S)-5-hydroxy-4-methoxy-2-methyl-6-prop-2-enoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2R,3S,4R,5R,6S)-6-allyloxy-5-hydroxy-4-methoxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C17H22O6 MolecularWeight: 322.35298

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OCC=C)O)OC)OC(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OCC=C)O)OC)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22O6/c1-4-10-21-17-13(18)15(20-3)14(11(2)22-17)23-16(19)12-8-6-5-7-9-12/h4-9,11,13-15,17-18H,1,10H2,2-3H3/t11-,13-,14+,15-,17+/m1/s1