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

Systemtic Name: [(2S,3S,4S,5R,6R)-5-iodanyl-4-[(4-methoxyphenyl)methoxy]-2-methyl-6-phenylmethoxy-oxan-3-yl] benzoate Openeye Name: [(2S,3S,4S,5R,6R)-6-benzyloxy-5-iodo-4-[(4-methoxyphenyl)methoxy]-2-methyl-tetrahydropyran-3-yl] benzoate CAS Name: benzoic acid [(2S,3S,4S,5R,6R)-5-iodo-4-[(4-methoxyphenyl)methoxy]-2-methyl-6-phenylmethoxy-3-oxanyl] ester IUPAC Name: [(2S,3S,4S,5R,6R)-5-iodo-4-[(4-methoxyphenyl)methoxy]-2-methyl-6-phenylmethoxyoxan-3-yl] benzoate Traditional Name: benzoic acid [(2S,3S,4S,5R,6R)-6-benzoxy-5-iodo-2-methyl-4-p-anisyloxy-tetrahydropyran-3-yl] ester Formula: C28H29IO6 MolecularWeight: 588.43073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OCC2=CC=CC=C2)I)OCC3=CC=C(C=C3)OC)OC(=O)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OCC2=CC=CC=C2)I)OCC3=CC=C(C=C3)OC)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H29IO6/c1-19-25(35-27(30)22-11-7-4-8-12-22)26(32-17-21-13-15-23(31-2)16-14-21)24(29)28(34-19)33-18-20-9-5-3-6-10-20/h3-16,19,24-26,28H,17-18H2,1-2H3/t19-,24+,25-,26+,28+/m0/s1