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

Systemtic Name: [(3R,4R,5S,6S)-4-(2-chloranylethanoyloxy)-6-methyl-2-oxidanyl-5-phenylmethoxy-oxan-3-yl] benzoate Openeye Name: [(3R,4R,5S,6S)-5-benzyloxy-4-(2-chloroacetyl)oxy-2-hydroxy-6-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(3R,4R,5S,6S)-4-(2-chloro-1-oxoethoxy)-2-hydroxy-6-methyl-5-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(3R,4R,5S,6S)-4-(2-chloroacetyl)oxy-2-hydroxy-6-methyl-5-phenylmethoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(3R,4R,5S,6S)-5-benzoxy-4-(2-chloroacetyl)oxy-2-hydroxy-6-methyl-tetrahydropyran-3-yl] ester Formula: C22H23ClO7 MolecularWeight: 434.86682

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)O)OC(=O)C2=CC=CC=C2)OC(=O)CCl)OCC3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@@H]([C@H]([C@H](C(O1)O)OC(=O)C2=CC=CC=C2)OC(=O)CCl)OCC3=CC=CC=C3

InChI

InChI=1S/C22H23ClO7/c1-14-18(27-13-15-8-4-2-5-9-15)19(29-17(24)12-23)20(22(26)28-14)30-21(25)16-10-6-3-7-11-16/h2-11,14,18-20,22,26H,12-13H2,1H3/t14-,18-,19+,20+,22?/m0/s1