(2R,3S,5R)-6-(5-bromanyl-2-methoxy-3-phenylmethoxy-phenyl)-5-methyl-2-phenylmethoxy-hexane-1,3-diol

Systemtic Name: (2R,3S,5R)-6-(5-bromanyl-2-methoxy-3-phenylmethoxy-phenyl)-5-methyl-2-phenylmethoxy-hexane-1,3-diol Openeye Name: (2R,3S,5R)-2-benzyloxy-6-(3-benzyloxy-5-bromo-2-methoxy-phenyl)-5-methyl-hexane-1,3-diol CAS Name: (2R,3S,5R)-6-(5-bromo-2-methoxy-3-phenylmethoxyphenyl)-5-methyl-2-phenylmethoxyhexane-1,3-diol IUPAC Name: (2R,3S,5R)-6-(5-bromo-2-methoxy-3-phenylmethoxyphenyl)-5-methyl-2-phenylmethoxyhexane-1,3-diol Traditional Name: (2R,3S,5R)-2-benzoxy-6-(3-benzoxy-5-bromo-2-methoxy-phenyl)-5-methyl-hexane-1,3-diol Formula: C28H33BrO5 MolecularWeight: 529.46262

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC(=C1OC)OCC2=CC=CC=C2)Br)CC(C(CO)OCC3=CC=CC=C3)O

Isomeric SMILES

C[C@H](CC1=CC(=CC(=C1OC)OCC2=CC=CC=C2)Br)C[C@@H]([C@@H](CO)OCC3=CC=CC=C3)O

InChI

InChI=1S/C28H33BrO5/c1-20(14-25(31)27(17-30)34-19-22-11-7-4-8-12-22)13-23-15-24(29)16-26(28(23)32-2)33-18-21-9-5-3-6-10-21/h3-12,15-16,20,25,27,30-31H,13-14,17-19H2,1-2H3/t20-,25+,27-/m1/s1