methyl (2S,3S,4R,5R,6R)-3-bromanyl-4-[(4-methoxyphenyl)methoxy]-2-oxidanyl-5-(phenylcarbonyloxy)-6-phenylmethoxy-oxane-2-carboxylate

Systemtic Name: methyl (2S,3S,4R,5R,6R)-3-bromanyl-4-[(4-methoxyphenyl)methoxy]-2-oxidanyl-5-(phenylcarbonyloxy)-6-phenylmethoxy-oxane-2-carboxylate Openeye Name: methyl (2S,3S,4R,5R,6R)-5-benzoyloxy-6-benzyloxy-3-bromo-2-hydroxy-4-[(4-methoxyphenyl)methoxy]tetrahydropyran-2-carboxylate CAS Name: (2S,3S,4R,5R,6R)-5-benzoyloxy-3-bromo-2-hydroxy-4-[(4-methoxyphenyl)methoxy]-6-phenylmethoxy-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5R,6R)-5-benzoyloxy-3-bromo-2-hydroxy-4-[(4-methoxyphenyl)methoxy]-6-phenylmethoxyoxane-2-carboxylate Traditional Name: (2S,3S,4R,5R,6R)-6-benzoxy-5-benzoyloxy-3-bromo-2-hydroxy-4-p-anisyloxy-tetrahydropyran-2-carboxylic acid methyl ester Formula: C29H29BrO9 MolecularWeight: 601.43916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC2C(C(OC(C2Br)(C(=O)OC)O)OCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)CO[C@@H]2[C@H]([C@@H](O[C@]([C@H]2Br)(C(=O)OC)O)OCC3=CC=CC=C3)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H29BrO9/c1-34-22-15-13-20(14-16-22)17-36-23-24(38-26(31)21-11-7-4-8-12-21)27(37-18-19-9-5-3-6-10-19)39-29(33,25(23)30)28(32)35-2/h3-16,23-25,27,33H,17-18H2,1-2H3/t23-,24-,25+,27-,29-/m1/s1