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

Systemtic Name: [(2S,3S,4R,5S,6S)-6-methoxy-2-methyl-4-oxidanyl-5-phenylmethoxy-oxan-3-yl] benzoate Openeye Name: [(2S,3S,4R,5S,6S)-5-benzyloxy-4-hydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2S,3S,4R,5S,6S)-4-hydroxy-6-methoxy-2-methyl-5-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4R,5S,6S)-4-hydroxy-6-methoxy-2-methyl-5-phenylmethoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2S,3S,4R,5S,6S)-5-benzoxy-4-hydroxy-6-methoxy-2-methyl-tetrahydropyran-3-yl] ester Formula: C21H24O6 MolecularWeight: 372.41166

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC)OCC2=CC=CC=C2)O)OC(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@H]([C@H]([C@@H]([C@H](O1)OC)OCC2=CC=CC=C2)O)OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24O6/c1-14-18(27-20(23)16-11-7-4-8-12-16)17(22)19(21(24-2)26-14)25-13-15-9-5-3-6-10-15/h3-12,14,17-19,21-22H,13H2,1-2H3/t14-,17+,18+,19-,21-/m0/s1